USER MOD reduce.3.24.130724 H: found=0, std=0, add=643, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 639 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 82 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 83 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 45 HIS : no HD1:sc= 0 X(o=0.1,f=-0.09) USER MOD Set 2.2: A 47 SER OG : rot 180:sc= 0.0997 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.0904 X(o=-0.09,f=-0.56) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 SER OG : rot 180:sc=-0.00841 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -0.0255 X(o=-0.025,f=-0.33) USER MOD Single : A 35 THR OG1 : rot -86:sc= 0.00463 USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.053) USER MOD Single : A 38 HIS : no HD1:sc= -0.0206 X(o=-0.021,f=-0.39) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 TYR OH : rot 76:sc= 1.23 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 70:sc= -0.441 USER MOD Single : A 61 MET CE :methyl -110:sc= -0.051 (180deg=-1.85!) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -117:sc= 1.22 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= -0.269 X(o=-0.27,f=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ -162:sc= -0.0154 (180deg=-0.198) USER MOD Single : A 80 ASN : amide:sc= -0.285 X(o=-0.28,f=-0.13) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot -15:sc= 0.18! USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 45.026 4.153 -6.219 1.00 0.00 N ATOM 2 CA GLY A 1 45.618 2.999 -5.568 1.00 0.00 C ATOM 3 C GLY A 1 46.453 3.379 -4.362 1.00 0.00 C ATOM 4 O GLY A 1 47.655 3.618 -4.481 1.00 0.00 O ATOM 0 H1 GLY A 1 44.465 3.840 -7.037 1.00 0.00 H new ATOM 0 H2 GLY A 1 44.409 4.652 -5.547 1.00 0.00 H new ATOM 0 H3 GLY A 1 45.779 4.795 -6.540 1.00 0.00 H new ATOM 0 HA2 GLY A 1 44.828 2.315 -5.258 1.00 0.00 H new ATOM 0 HA3 GLY A 1 46.241 2.462 -6.283 1.00 0.00 H new ATOM 8 N SER A 2 45.816 3.436 -3.197 1.00 0.00 N ATOM 9 CA SER A 2 46.508 3.795 -1.964 1.00 0.00 C ATOM 10 C SER A 2 46.806 2.555 -1.127 1.00 0.00 C ATOM 11 O SER A 2 46.239 1.487 -1.357 1.00 0.00 O ATOM 12 CB SER A 2 45.668 4.783 -1.152 1.00 0.00 C ATOM 13 OG SER A 2 44.710 5.431 -1.971 1.00 0.00 O ATOM 0 H SER A 2 44.822 3.238 -3.081 1.00 0.00 H new ATOM 0 HA SER A 2 47.453 4.267 -2.231 1.00 0.00 H new ATOM 0 HB2 SER A 2 45.162 4.256 -0.343 1.00 0.00 H new ATOM 0 HB3 SER A 2 46.319 5.526 -0.691 1.00 0.00 H new ATOM 0 HG SER A 2 44.185 6.056 -1.428 1.00 0.00 H new ATOM 19 N SER A 3 47.699 2.705 -0.155 1.00 0.00 N ATOM 20 CA SER A 3 48.076 1.597 0.715 1.00 0.00 C ATOM 21 C SER A 3 47.498 1.784 2.115 1.00 0.00 C ATOM 22 O SER A 3 46.847 2.788 2.401 1.00 0.00 O ATOM 23 CB SER A 3 49.599 1.477 0.793 1.00 0.00 C ATOM 24 OG SER A 3 50.085 0.538 -0.150 1.00 0.00 O ATOM 0 H SER A 3 48.175 3.583 0.050 1.00 0.00 H new ATOM 0 HA SER A 3 47.667 0.680 0.291 1.00 0.00 H new ATOM 0 HB2 SER A 3 50.054 2.450 0.609 1.00 0.00 H new ATOM 0 HB3 SER A 3 49.892 1.173 1.798 1.00 0.00 H new ATOM 0 HG SER A 3 51.061 0.481 -0.081 1.00 0.00 H new ATOM 30 N GLY A 4 47.741 0.808 2.984 1.00 0.00 N ATOM 31 CA GLY A 4 47.238 0.883 4.343 1.00 0.00 C ATOM 32 C GLY A 4 46.022 0.004 4.561 1.00 0.00 C ATOM 33 O GLY A 4 46.085 -0.986 5.289 1.00 0.00 O ATOM 0 H GLY A 4 48.277 -0.033 2.771 1.00 0.00 H new ATOM 0 HA2 GLY A 4 48.026 0.586 5.035 1.00 0.00 H new ATOM 0 HA3 GLY A 4 46.982 1.917 4.576 1.00 0.00 H new ATOM 37 N SER A 5 44.910 0.368 3.929 1.00 0.00 N ATOM 38 CA SER A 5 43.672 -0.392 4.061 1.00 0.00 C ATOM 39 C SER A 5 43.058 -0.672 2.693 1.00 0.00 C ATOM 40 O SER A 5 43.085 0.177 1.802 1.00 0.00 O ATOM 41 CB SER A 5 42.673 0.369 4.935 1.00 0.00 C ATOM 42 OG SER A 5 42.889 0.100 6.309 1.00 0.00 O ATOM 0 H SER A 5 44.841 1.184 3.321 1.00 0.00 H new ATOM 0 HA SER A 5 43.908 -1.344 4.536 1.00 0.00 H new ATOM 0 HB2 SER A 5 42.766 1.439 4.752 1.00 0.00 H new ATOM 0 HB3 SER A 5 41.657 0.086 4.661 1.00 0.00 H new ATOM 0 HG SER A 5 42.239 0.599 6.846 1.00 0.00 H new ATOM 48 N SER A 6 42.506 -1.871 2.534 1.00 0.00 N ATOM 49 CA SER A 6 41.888 -2.267 1.274 1.00 0.00 C ATOM 50 C SER A 6 40.394 -1.960 1.282 1.00 0.00 C ATOM 51 O SER A 6 39.701 -2.215 2.266 1.00 0.00 O ATOM 52 CB SER A 6 42.112 -3.758 1.018 1.00 0.00 C ATOM 53 OG SER A 6 41.592 -4.143 -0.242 1.00 0.00 O ATOM 0 H SER A 6 42.474 -2.585 3.262 1.00 0.00 H new ATOM 0 HA SER A 6 42.355 -1.694 0.473 1.00 0.00 H new ATOM 0 HB2 SER A 6 43.178 -3.981 1.058 1.00 0.00 H new ATOM 0 HB3 SER A 6 41.635 -4.341 1.805 1.00 0.00 H new ATOM 0 HG SER A 6 41.749 -5.100 -0.382 1.00 0.00 H new ATOM 59 N GLY A 7 39.903 -1.409 0.175 1.00 0.00 N ATOM 60 CA GLY A 7 38.495 -1.075 0.074 1.00 0.00 C ATOM 61 C GLY A 7 37.738 -2.024 -0.834 1.00 0.00 C ATOM 62 O GLY A 7 38.294 -2.545 -1.802 1.00 0.00 O ATOM 0 H GLY A 7 40.456 -1.188 -0.653 1.00 0.00 H new ATOM 0 HA2 GLY A 7 38.048 -1.094 1.068 1.00 0.00 H new ATOM 0 HA3 GLY A 7 38.392 -0.057 -0.302 1.00 0.00 H new ATOM 66 N ARG A 8 36.466 -2.252 -0.522 1.00 0.00 N ATOM 67 CA ARG A 8 35.633 -3.147 -1.315 1.00 0.00 C ATOM 68 C ARG A 8 35.417 -2.588 -2.719 1.00 0.00 C ATOM 69 O ARG A 8 35.237 -1.383 -2.898 1.00 0.00 O ATOM 70 CB ARG A 8 34.283 -3.365 -0.629 1.00 0.00 C ATOM 71 CG ARG A 8 33.406 -2.124 -0.604 1.00 0.00 C ATOM 72 CD ARG A 8 32.529 -2.087 0.638 1.00 0.00 C ATOM 73 NE ARG A 8 31.537 -1.017 0.576 1.00 0.00 N ATOM 74 CZ ARG A 8 30.429 -1.083 -0.153 1.00 0.00 C ATOM 75 NH1 ARG A 8 30.172 -2.163 -0.878 1.00 0.00 N ATOM 76 NH2 ARG A 8 29.575 -0.068 -0.157 1.00 0.00 N ATOM 0 H ARG A 8 35.990 -1.829 0.275 1.00 0.00 H new ATOM 0 HA ARG A 8 36.149 -4.103 -1.398 1.00 0.00 H new ATOM 0 HB2 ARG A 8 33.750 -4.166 -1.141 1.00 0.00 H new ATOM 0 HB3 ARG A 8 34.455 -3.699 0.394 1.00 0.00 H new ATOM 0 HG2 ARG A 8 34.033 -1.233 -0.635 1.00 0.00 H new ATOM 0 HG3 ARG A 8 32.778 -2.103 -1.495 1.00 0.00 H new ATOM 0 HD2 ARG A 8 32.022 -3.045 0.752 1.00 0.00 H new ATOM 0 HD3 ARG A 8 33.155 -1.950 1.520 1.00 0.00 H new ATOM 0 HE ARG A 8 31.704 -0.172 1.123 1.00 0.00 H new ATOM 0 HH11 ARG A 8 30.826 -2.946 -0.877 1.00 0.00 H new ATOM 0 HH12 ARG A 8 29.320 -2.211 -1.437 1.00 0.00 H new ATOM 0 HH21 ARG A 8 29.769 0.764 0.400 1.00 0.00 H new ATOM 0 HH22 ARG A 8 28.724 -0.120 -0.717 1.00 0.00 H new ATOM 90 N LEU A 9 35.437 -3.471 -3.711 1.00 0.00 N ATOM 91 CA LEU A 9 35.244 -3.066 -5.099 1.00 0.00 C ATOM 92 C LEU A 9 33.786 -3.229 -5.517 1.00 0.00 C ATOM 93 O LEU A 9 32.976 -3.787 -4.776 1.00 0.00 O ATOM 94 CB LEU A 9 36.146 -3.889 -6.021 1.00 0.00 C ATOM 95 CG LEU A 9 35.783 -5.368 -6.169 1.00 0.00 C ATOM 96 CD1 LEU A 9 35.134 -5.626 -7.520 1.00 0.00 C ATOM 97 CD2 LEU A 9 37.018 -6.239 -5.994 1.00 0.00 C ATOM 0 H LEU A 9 35.585 -4.472 -3.580 1.00 0.00 H new ATOM 0 HA LEU A 9 35.511 -2.013 -5.185 1.00 0.00 H new ATOM 0 HB2 LEU A 9 36.135 -3.432 -7.010 1.00 0.00 H new ATOM 0 HB3 LEU A 9 37.169 -3.822 -5.651 1.00 0.00 H new ATOM 0 HG LEU A 9 35.066 -5.627 -5.390 1.00 0.00 H new ATOM 0 HD11 LEU A 9 34.883 -6.683 -7.607 1.00 0.00 H new ATOM 0 HD12 LEU A 9 34.226 -5.029 -7.608 1.00 0.00 H new ATOM 0 HD13 LEU A 9 35.827 -5.351 -8.315 1.00 0.00 H new ATOM 0 HD21 LEU A 9 36.742 -7.288 -6.102 1.00 0.00 H new ATOM 0 HD22 LEU A 9 37.757 -5.978 -6.751 1.00 0.00 H new ATOM 0 HD23 LEU A 9 37.441 -6.076 -5.003 1.00 0.00 H new ATOM 109 N LEU A 10 33.459 -2.741 -6.708 1.00 0.00 N ATOM 110 CA LEU A 10 32.099 -2.834 -7.226 1.00 0.00 C ATOM 111 C LEU A 10 31.918 -4.101 -8.056 1.00 0.00 C ATOM 112 O LEU A 10 32.437 -4.208 -9.166 1.00 0.00 O ATOM 113 CB LEU A 10 31.769 -1.604 -8.073 1.00 0.00 C ATOM 114 CG LEU A 10 30.759 -0.626 -7.473 1.00 0.00 C ATOM 115 CD1 LEU A 10 29.388 -1.275 -7.364 1.00 0.00 C ATOM 116 CD2 LEU A 10 31.231 -0.142 -6.110 1.00 0.00 C ATOM 0 H LEU A 10 34.117 -2.277 -7.334 1.00 0.00 H new ATOM 0 HA LEU A 10 31.416 -2.877 -6.378 1.00 0.00 H new ATOM 0 HB2 LEU A 10 32.695 -1.064 -8.269 1.00 0.00 H new ATOM 0 HB3 LEU A 10 31.388 -1.943 -9.036 1.00 0.00 H new ATOM 0 HG LEU A 10 30.679 0.236 -8.135 1.00 0.00 H new ATOM 0 HD11 LEU A 10 28.682 -0.564 -6.935 1.00 0.00 H new ATOM 0 HD12 LEU A 10 29.046 -1.572 -8.355 1.00 0.00 H new ATOM 0 HD13 LEU A 10 29.452 -2.155 -6.723 1.00 0.00 H new ATOM 0 HD21 LEU A 10 30.500 0.553 -5.698 1.00 0.00 H new ATOM 0 HD22 LEU A 10 31.340 -0.994 -5.439 1.00 0.00 H new ATOM 0 HD23 LEU A 10 32.192 0.362 -6.216 1.00 0.00 H new ATOM 128 N GLY A 11 31.175 -5.059 -7.510 1.00 0.00 N ATOM 129 CA GLY A 11 30.936 -6.306 -8.214 1.00 0.00 C ATOM 130 C GLY A 11 30.034 -7.246 -7.440 1.00 0.00 C ATOM 131 O GLY A 11 30.294 -8.447 -7.367 1.00 0.00 O ATOM 0 H GLY A 11 30.734 -4.994 -6.592 1.00 0.00 H new ATOM 0 HA2 GLY A 11 30.486 -6.092 -9.183 1.00 0.00 H new ATOM 0 HA3 GLY A 11 31.889 -6.799 -8.407 1.00 0.00 H new ATOM 135 N ARG A 12 28.971 -6.699 -6.858 1.00 0.00 N ATOM 136 CA ARG A 12 28.029 -7.497 -6.083 1.00 0.00 C ATOM 137 C ARG A 12 28.744 -8.243 -4.960 1.00 0.00 C ATOM 138 O ARG A 12 29.120 -9.405 -5.115 1.00 0.00 O ATOM 139 CB ARG A 12 27.304 -8.492 -6.990 1.00 0.00 C ATOM 140 CG ARG A 12 26.128 -9.183 -6.318 1.00 0.00 C ATOM 141 CD ARG A 12 24.853 -8.364 -6.447 1.00 0.00 C ATOM 142 NE ARG A 12 24.461 -7.759 -5.178 1.00 0.00 N ATOM 143 CZ ARG A 12 23.413 -6.954 -5.040 1.00 0.00 C ATOM 144 NH1 ARG A 12 22.656 -6.661 -6.088 1.00 0.00 N ATOM 145 NH2 ARG A 12 23.120 -6.441 -3.852 1.00 0.00 N ATOM 0 H ARG A 12 28.741 -5.707 -6.909 1.00 0.00 H new ATOM 0 HA ARG A 12 27.298 -6.821 -5.639 1.00 0.00 H new ATOM 0 HB2 ARG A 12 26.948 -7.969 -7.878 1.00 0.00 H new ATOM 0 HB3 ARG A 12 28.014 -9.247 -7.328 1.00 0.00 H new ATOM 0 HG2 ARG A 12 25.978 -10.165 -6.766 1.00 0.00 H new ATOM 0 HG3 ARG A 12 26.353 -9.344 -5.264 1.00 0.00 H new ATOM 0 HD2 ARG A 12 24.998 -7.582 -7.192 1.00 0.00 H new ATOM 0 HD3 ARG A 12 24.047 -9.003 -6.809 1.00 0.00 H new ATOM 0 HE ARG A 12 25.022 -7.965 -4.352 1.00 0.00 H new ATOM 0 HH11 ARG A 12 22.878 -7.054 -7.003 1.00 0.00 H new ATOM 0 HH12 ARG A 12 21.852 -6.043 -5.979 1.00 0.00 H new ATOM 0 HH21 ARG A 12 23.700 -6.664 -3.043 1.00 0.00 H new ATOM 0 HH22 ARG A 12 22.315 -5.823 -3.748 1.00 0.00 H new ATOM 159 N ASN A 13 28.929 -7.567 -3.831 1.00 0.00 N ATOM 160 CA ASN A 13 29.600 -8.166 -2.683 1.00 0.00 C ATOM 161 C ASN A 13 28.865 -7.832 -1.388 1.00 0.00 C ATOM 162 O ASN A 13 29.117 -6.798 -0.769 1.00 0.00 O ATOM 163 CB ASN A 13 31.048 -7.679 -2.601 1.00 0.00 C ATOM 164 CG ASN A 13 32.013 -8.614 -3.305 1.00 0.00 C ATOM 165 OD1 ASN A 13 31.925 -9.834 -3.167 1.00 0.00 O ATOM 166 ND2 ASN A 13 32.941 -8.043 -4.064 1.00 0.00 N ATOM 0 H ASN A 13 28.624 -6.605 -3.686 1.00 0.00 H new ATOM 0 HA ASN A 13 29.595 -9.248 -2.814 1.00 0.00 H new ATOM 0 HB2 ASN A 13 31.120 -6.686 -3.044 1.00 0.00 H new ATOM 0 HB3 ASN A 13 31.338 -7.583 -1.555 1.00 0.00 H new ATOM 0 HD21 ASN A 13 33.619 -8.620 -4.562 1.00 0.00 H new ATOM 0 HD22 ASN A 13 32.976 -7.027 -4.149 1.00 0.00 H new ATOM 173 N SER A 14 27.956 -8.714 -0.985 1.00 0.00 N ATOM 174 CA SER A 14 27.182 -8.511 0.234 1.00 0.00 C ATOM 175 C SER A 14 27.482 -9.604 1.256 1.00 0.00 C ATOM 176 O SER A 14 27.683 -9.327 2.437 1.00 0.00 O ATOM 177 CB SER A 14 25.686 -8.491 -0.084 1.00 0.00 C ATOM 178 OG SER A 14 25.454 -8.072 -1.418 1.00 0.00 O ATOM 0 H SER A 14 27.737 -9.576 -1.485 1.00 0.00 H new ATOM 0 HA SER A 14 27.468 -7.550 0.661 1.00 0.00 H new ATOM 0 HB2 SER A 14 25.266 -9.485 0.067 1.00 0.00 H new ATOM 0 HB3 SER A 14 25.173 -7.820 0.606 1.00 0.00 H new ATOM 0 HG SER A 14 24.491 -8.069 -1.597 1.00 0.00 H new ATOM 184 N ASN A 15 27.510 -10.849 0.790 1.00 0.00 N ATOM 185 CA ASN A 15 27.784 -11.985 1.662 1.00 0.00 C ATOM 186 C ASN A 15 29.141 -11.834 2.342 1.00 0.00 C ATOM 187 O ASN A 15 29.289 -12.128 3.528 1.00 0.00 O ATOM 188 CB ASN A 15 27.743 -13.289 0.863 1.00 0.00 C ATOM 189 CG ASN A 15 27.231 -14.456 1.686 1.00 0.00 C ATOM 190 OD1 ASN A 15 27.930 -14.968 2.560 1.00 0.00 O ATOM 191 ND2 ASN A 15 26.004 -14.881 1.408 1.00 0.00 N ATOM 0 H ASN A 15 27.346 -11.096 -0.186 1.00 0.00 H new ATOM 0 HA ASN A 15 27.013 -12.014 2.432 1.00 0.00 H new ATOM 0 HB2 ASN A 15 27.105 -13.157 -0.011 1.00 0.00 H new ATOM 0 HB3 ASN A 15 28.743 -13.518 0.495 1.00 0.00 H new ATOM 0 HD21 ASN A 15 25.605 -15.662 1.928 1.00 0.00 H new ATOM 0 HD22 ASN A 15 25.461 -14.426 0.674 1.00 0.00 H new ATOM 198 N SER A 16 30.130 -11.373 1.582 1.00 0.00 N ATOM 199 CA SER A 16 31.476 -11.185 2.110 1.00 0.00 C ATOM 200 C SER A 16 32.078 -12.517 2.548 1.00 0.00 C ATOM 201 O SER A 16 32.403 -12.709 3.719 1.00 0.00 O ATOM 202 CB SER A 16 31.453 -10.210 3.288 1.00 0.00 C ATOM 203 OG SER A 16 30.445 -9.229 3.120 1.00 0.00 O ATOM 0 H SER A 16 30.024 -11.123 0.599 1.00 0.00 H new ATOM 0 HA SER A 16 32.097 -10.769 1.316 1.00 0.00 H new ATOM 0 HB2 SER A 16 31.280 -10.758 4.214 1.00 0.00 H new ATOM 0 HB3 SER A 16 32.425 -9.725 3.381 1.00 0.00 H new ATOM 0 HG SER A 16 30.451 -8.620 3.887 1.00 0.00 H new ATOM 209 N LYS A 17 32.224 -13.434 1.598 1.00 0.00 N ATOM 210 CA LYS A 17 32.787 -14.748 1.882 1.00 0.00 C ATOM 211 C LYS A 17 34.291 -14.762 1.628 1.00 0.00 C ATOM 212 O LYS A 17 34.741 -14.591 0.495 1.00 0.00 O ATOM 213 CB LYS A 17 32.105 -15.816 1.023 1.00 0.00 C ATOM 214 CG LYS A 17 31.779 -17.090 1.782 1.00 0.00 C ATOM 215 CD LYS A 17 32.656 -18.247 1.334 1.00 0.00 C ATOM 216 CE LYS A 17 31.922 -19.159 0.363 1.00 0.00 C ATOM 217 NZ LYS A 17 32.089 -18.715 -1.049 1.00 0.00 N ATOM 0 H LYS A 17 31.960 -13.291 0.623 1.00 0.00 H new ATOM 0 HA LYS A 17 32.611 -14.970 2.935 1.00 0.00 H new ATOM 0 HB2 LYS A 17 31.185 -15.404 0.609 1.00 0.00 H new ATOM 0 HB3 LYS A 17 32.752 -16.060 0.181 1.00 0.00 H new ATOM 0 HG2 LYS A 17 31.914 -16.922 2.851 1.00 0.00 H new ATOM 0 HG3 LYS A 17 30.731 -17.347 1.630 1.00 0.00 H new ATOM 0 HD2 LYS A 17 33.558 -17.859 0.860 1.00 0.00 H new ATOM 0 HD3 LYS A 17 32.975 -18.821 2.204 1.00 0.00 H new ATOM 0 HE2 LYS A 17 32.294 -20.178 0.470 1.00 0.00 H new ATOM 0 HE3 LYS A 17 30.862 -19.179 0.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 31.574 -19.362 -1.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 31.711 -17.752 -1.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 33.099 -18.720 -1.297 1.00 0.00 H new ATOM 231 N ARG A 18 35.064 -14.966 2.690 1.00 0.00 N ATOM 232 CA ARG A 18 36.518 -15.002 2.582 1.00 0.00 C ATOM 233 C ARG A 18 37.063 -16.353 3.035 1.00 0.00 C ATOM 234 O ARG A 18 36.717 -16.846 4.110 1.00 0.00 O ATOM 235 CB ARG A 18 37.140 -13.882 3.417 1.00 0.00 C ATOM 236 CG ARG A 18 36.769 -13.942 4.890 1.00 0.00 C ATOM 237 CD ARG A 18 37.916 -14.479 5.732 1.00 0.00 C ATOM 238 NE ARG A 18 37.614 -14.436 7.160 1.00 0.00 N ATOM 239 CZ ARG A 18 38.484 -14.771 8.106 1.00 0.00 C ATOM 240 NH1 ARG A 18 39.705 -15.170 7.777 1.00 0.00 N ATOM 241 NH2 ARG A 18 38.134 -14.706 9.384 1.00 0.00 N ATOM 0 H ARG A 18 34.708 -15.109 3.635 1.00 0.00 H new ATOM 0 HA ARG A 18 36.784 -14.855 1.535 1.00 0.00 H new ATOM 0 HB2 ARG A 18 38.225 -13.929 3.322 1.00 0.00 H new ATOM 0 HB3 ARG A 18 36.826 -12.920 3.011 1.00 0.00 H new ATOM 0 HG2 ARG A 18 36.496 -12.946 5.238 1.00 0.00 H new ATOM 0 HG3 ARG A 18 35.892 -14.577 5.020 1.00 0.00 H new ATOM 0 HD2 ARG A 18 38.131 -15.506 5.438 1.00 0.00 H new ATOM 0 HD3 ARG A 18 38.815 -13.895 5.534 1.00 0.00 H new ATOM 0 HE ARG A 18 36.684 -14.132 7.447 1.00 0.00 H new ATOM 0 HH11 ARG A 18 39.978 -15.220 6.795 1.00 0.00 H new ATOM 0 HH12 ARG A 18 40.371 -15.427 8.505 1.00 0.00 H new ATOM 0 HH21 ARG A 18 37.196 -14.399 9.641 1.00 0.00 H new ATOM 0 HH22 ARG A 18 38.803 -14.964 10.110 1.00 0.00 H new ATOM 255 N LEU A 19 37.918 -16.947 2.209 1.00 0.00 N ATOM 256 CA LEU A 19 38.512 -18.242 2.525 1.00 0.00 C ATOM 257 C LEU A 19 39.988 -18.272 2.141 1.00 0.00 C ATOM 258 O LEU A 19 40.348 -18.003 0.994 1.00 0.00 O ATOM 259 CB LEU A 19 37.762 -19.360 1.798 1.00 0.00 C ATOM 260 CG LEU A 19 36.241 -19.359 1.954 1.00 0.00 C ATOM 261 CD1 LEU A 19 35.596 -20.254 0.906 1.00 0.00 C ATOM 262 CD2 LEU A 19 35.848 -19.806 3.354 1.00 0.00 C ATOM 0 H LEU A 19 38.215 -16.553 1.316 1.00 0.00 H new ATOM 0 HA LEU A 19 38.432 -18.398 3.601 1.00 0.00 H new ATOM 0 HB2 LEU A 19 37.998 -19.298 0.736 1.00 0.00 H new ATOM 0 HB3 LEU A 19 38.143 -20.317 2.154 1.00 0.00 H new ATOM 0 HG LEU A 19 35.881 -18.341 1.805 1.00 0.00 H new ATOM 0 HD11 LEU A 19 34.513 -20.241 1.033 1.00 0.00 H new ATOM 0 HD12 LEU A 19 35.849 -19.889 -0.090 1.00 0.00 H new ATOM 0 HD13 LEU A 19 35.963 -21.274 1.023 1.00 0.00 H new ATOM 0 HD21 LEU A 19 34.762 -19.799 3.447 1.00 0.00 H new ATOM 0 HD22 LEU A 19 36.221 -20.815 3.532 1.00 0.00 H new ATOM 0 HD23 LEU A 19 36.279 -19.125 4.088 1.00 0.00 H new ATOM 274 N LEU A 20 40.838 -18.601 3.107 1.00 0.00 N ATOM 275 CA LEU A 20 42.276 -18.669 2.871 1.00 0.00 C ATOM 276 C LEU A 20 42.708 -20.096 2.548 1.00 0.00 C ATOM 277 O LEU A 20 42.004 -21.055 2.861 1.00 0.00 O ATOM 278 CB LEU A 20 43.038 -18.158 4.095 1.00 0.00 C ATOM 279 CG LEU A 20 43.356 -16.662 4.112 1.00 0.00 C ATOM 280 CD1 LEU A 20 42.096 -15.852 4.375 1.00 0.00 C ATOM 281 CD2 LEU A 20 44.419 -16.354 5.156 1.00 0.00 C ATOM 0 H LEU A 20 40.556 -18.825 4.061 1.00 0.00 H new ATOM 0 HA LEU A 20 42.509 -18.036 2.015 1.00 0.00 H new ATOM 0 HB2 LEU A 20 42.456 -18.395 4.985 1.00 0.00 H new ATOM 0 HB3 LEU A 20 43.975 -18.709 4.171 1.00 0.00 H new ATOM 0 HG LEU A 20 43.746 -16.382 3.133 1.00 0.00 H new ATOM 0 HD11 LEU A 20 42.341 -14.790 4.384 1.00 0.00 H new ATOM 0 HD12 LEU A 20 41.366 -16.049 3.590 1.00 0.00 H new ATOM 0 HD13 LEU A 20 41.676 -16.135 5.340 1.00 0.00 H new ATOM 0 HD21 LEU A 20 44.632 -15.285 5.154 1.00 0.00 H new ATOM 0 HD22 LEU A 20 44.058 -16.650 6.141 1.00 0.00 H new ATOM 0 HD23 LEU A 20 45.329 -16.906 4.922 1.00 0.00 H new ATOM 293 N GLY A 21 43.873 -20.228 1.920 1.00 0.00 N ATOM 294 CA GLY A 21 44.380 -21.541 1.567 1.00 0.00 C ATOM 295 C GLY A 21 45.895 -21.600 1.582 1.00 0.00 C ATOM 296 O GLY A 21 46.552 -20.735 2.161 1.00 0.00 O ATOM 0 H GLY A 21 44.474 -19.449 1.650 1.00 0.00 H new ATOM 0 HA2 GLY A 21 43.984 -22.280 2.264 1.00 0.00 H new ATOM 0 HA3 GLY A 21 44.019 -21.812 0.575 1.00 0.00 H new ATOM 300 N TYR A 22 46.451 -22.625 0.945 1.00 0.00 N ATOM 301 CA TYR A 22 47.898 -22.796 0.890 1.00 0.00 C ATOM 302 C TYR A 22 48.343 -23.233 -0.502 1.00 0.00 C ATOM 303 O TYR A 22 47.817 -24.196 -1.061 1.00 0.00 O ATOM 304 CB TYR A 22 48.350 -23.825 1.928 1.00 0.00 C ATOM 305 CG TYR A 22 47.922 -23.490 3.339 1.00 0.00 C ATOM 306 CD1 TYR A 22 48.295 -22.290 3.933 1.00 0.00 C ATOM 307 CD2 TYR A 22 47.144 -24.373 4.078 1.00 0.00 C ATOM 308 CE1 TYR A 22 47.907 -21.981 5.222 1.00 0.00 C ATOM 309 CE2 TYR A 22 46.750 -24.071 5.367 1.00 0.00 C ATOM 310 CZ TYR A 22 47.135 -22.874 5.935 1.00 0.00 C ATOM 311 OH TYR A 22 46.745 -22.568 7.219 1.00 0.00 O ATOM 0 H TYR A 22 45.922 -23.350 0.460 1.00 0.00 H new ATOM 0 HA TYR A 22 48.361 -21.835 1.114 1.00 0.00 H new ATOM 0 HB2 TYR A 22 47.949 -24.802 1.658 1.00 0.00 H new ATOM 0 HB3 TYR A 22 49.436 -23.907 1.897 1.00 0.00 H new ATOM 0 HD1 TYR A 22 48.898 -21.587 3.377 1.00 0.00 H new ATOM 0 HD2 TYR A 22 46.842 -25.311 3.637 1.00 0.00 H new ATOM 0 HE1 TYR A 22 48.207 -21.045 5.669 1.00 0.00 H new ATOM 0 HE2 TYR A 22 46.144 -24.768 5.927 1.00 0.00 H new ATOM 0 HH TYR A 22 46.205 -23.302 7.581 1.00 0.00 H new ATOM 321 N VAL A 23 49.316 -22.517 -1.057 1.00 0.00 N ATOM 322 CA VAL A 23 49.835 -22.830 -2.383 1.00 0.00 C ATOM 323 C VAL A 23 50.365 -24.258 -2.443 1.00 0.00 C ATOM 324 O VAL A 23 51.478 -24.537 -1.998 1.00 0.00 O ATOM 325 CB VAL A 23 50.959 -21.859 -2.790 1.00 0.00 C ATOM 326 CG1 VAL A 23 51.481 -22.198 -4.178 1.00 0.00 C ATOM 327 CG2 VAL A 23 50.467 -20.421 -2.733 1.00 0.00 C ATOM 0 H VAL A 23 49.761 -21.716 -0.609 1.00 0.00 H new ATOM 0 HA VAL A 23 49.004 -22.725 -3.081 1.00 0.00 H new ATOM 0 HB VAL A 23 51.781 -21.966 -2.083 1.00 0.00 H new ATOM 0 HG11 VAL A 23 52.275 -21.501 -4.448 1.00 0.00 H new ATOM 0 HG12 VAL A 23 51.874 -23.215 -4.181 1.00 0.00 H new ATOM 0 HG13 VAL A 23 50.669 -22.121 -4.901 1.00 0.00 H new ATOM 0 HG21 VAL A 23 51.274 -19.749 -3.024 1.00 0.00 H new ATOM 0 HG22 VAL A 23 49.627 -20.296 -3.416 1.00 0.00 H new ATOM 0 HG23 VAL A 23 50.147 -20.186 -1.718 1.00 0.00 H new ATOM 337 N ALA A 24 49.560 -25.160 -2.997 1.00 0.00 N ATOM 338 CA ALA A 24 49.950 -26.559 -3.118 1.00 0.00 C ATOM 339 C ALA A 24 51.052 -26.735 -4.157 1.00 0.00 C ATOM 340 O ALA A 24 52.129 -27.250 -3.855 1.00 0.00 O ATOM 341 CB ALA A 24 48.743 -27.413 -3.476 1.00 0.00 C ATOM 0 H ALA A 24 48.634 -24.946 -3.369 1.00 0.00 H new ATOM 0 HA ALA A 24 50.341 -26.886 -2.155 1.00 0.00 H new ATOM 0 HB1 ALA A 24 49.048 -28.456 -3.563 1.00 0.00 H new ATOM 0 HB2 ALA A 24 47.987 -27.320 -2.696 1.00 0.00 H new ATOM 0 HB3 ALA A 24 48.327 -27.076 -4.426 1.00 0.00 H new ATOM 347 N THR A 25 50.776 -26.304 -5.384 1.00 0.00 N ATOM 348 CA THR A 25 51.743 -26.416 -6.469 1.00 0.00 C ATOM 349 C THR A 25 51.750 -25.158 -7.330 1.00 0.00 C ATOM 350 O THR A 25 50.714 -24.522 -7.527 1.00 0.00 O ATOM 351 CB THR A 25 51.447 -27.635 -7.362 1.00 0.00 C ATOM 352 OG1 THR A 25 51.329 -28.814 -6.559 1.00 0.00 O ATOM 353 CG2 THR A 25 52.546 -27.828 -8.396 1.00 0.00 C ATOM 0 H THR A 25 49.890 -25.874 -5.651 1.00 0.00 H new ATOM 0 HA THR A 25 52.723 -26.543 -6.008 1.00 0.00 H new ATOM 0 HB THR A 25 50.507 -27.455 -7.883 1.00 0.00 H new ATOM 0 HG1 THR A 25 51.139 -29.584 -7.135 1.00 0.00 H new ATOM 0 HG21 THR A 25 52.315 -28.695 -9.015 1.00 0.00 H new ATOM 0 HG22 THR A 25 52.614 -26.940 -9.025 1.00 0.00 H new ATOM 0 HG23 THR A 25 53.498 -27.987 -7.890 1.00 0.00 H new ATOM 361 N LEU A 26 52.924 -24.805 -7.843 1.00 0.00 N ATOM 362 CA LEU A 26 53.066 -23.622 -8.685 1.00 0.00 C ATOM 363 C LEU A 26 53.756 -23.970 -10.000 1.00 0.00 C ATOM 364 O LEU A 26 54.951 -24.265 -10.027 1.00 0.00 O ATOM 365 CB LEU A 26 53.858 -22.540 -7.950 1.00 0.00 C ATOM 366 CG LEU A 26 53.033 -21.438 -7.286 1.00 0.00 C ATOM 367 CD1 LEU A 26 53.903 -20.607 -6.356 1.00 0.00 C ATOM 368 CD2 LEU A 26 52.379 -20.554 -8.338 1.00 0.00 C ATOM 0 H LEU A 26 53.791 -25.321 -7.691 1.00 0.00 H new ATOM 0 HA LEU A 26 52.069 -23.243 -8.909 1.00 0.00 H new ATOM 0 HB2 LEU A 26 54.467 -23.021 -7.185 1.00 0.00 H new ATOM 0 HB3 LEU A 26 54.544 -22.076 -8.659 1.00 0.00 H new ATOM 0 HG LEU A 26 52.247 -21.906 -6.694 1.00 0.00 H new ATOM 0 HD11 LEU A 26 53.299 -19.827 -5.892 1.00 0.00 H new ATOM 0 HD12 LEU A 26 54.324 -21.248 -5.582 1.00 0.00 H new ATOM 0 HD13 LEU A 26 54.711 -20.149 -6.926 1.00 0.00 H new ATOM 0 HD21 LEU A 26 51.796 -19.775 -7.847 1.00 0.00 H new ATOM 0 HD22 LEU A 26 53.149 -20.095 -8.957 1.00 0.00 H new ATOM 0 HD23 LEU A 26 51.723 -21.158 -8.964 1.00 0.00 H new ATOM 380 N LYS A 27 52.997 -23.932 -11.090 1.00 0.00 N ATOM 381 CA LYS A 27 53.535 -24.240 -12.409 1.00 0.00 C ATOM 382 C LYS A 27 53.821 -22.962 -13.192 1.00 0.00 C ATOM 383 O LYS A 27 53.670 -21.857 -12.670 1.00 0.00 O ATOM 384 CB LYS A 27 52.556 -25.120 -13.190 1.00 0.00 C ATOM 385 CG LYS A 27 52.151 -26.383 -12.450 1.00 0.00 C ATOM 386 CD LYS A 27 53.347 -27.282 -12.187 1.00 0.00 C ATOM 387 CE LYS A 27 53.207 -28.619 -12.899 1.00 0.00 C ATOM 388 NZ LYS A 27 53.735 -28.565 -14.290 1.00 0.00 N ATOM 0 H LYS A 27 52.006 -23.691 -11.085 1.00 0.00 H new ATOM 0 HA LYS A 27 54.472 -24.781 -12.274 1.00 0.00 H new ATOM 0 HB2 LYS A 27 51.662 -24.540 -13.418 1.00 0.00 H new ATOM 0 HB3 LYS A 27 53.009 -25.396 -14.142 1.00 0.00 H new ATOM 0 HG2 LYS A 27 51.680 -26.116 -11.504 1.00 0.00 H new ATOM 0 HG3 LYS A 27 51.408 -26.926 -13.034 1.00 0.00 H new ATOM 0 HD2 LYS A 27 54.258 -26.785 -12.521 1.00 0.00 H new ATOM 0 HD3 LYS A 27 53.449 -27.449 -11.115 1.00 0.00 H new ATOM 0 HE2 LYS A 27 53.740 -29.387 -12.338 1.00 0.00 H new ATOM 0 HE3 LYS A 27 52.157 -28.911 -12.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 53.621 -29.495 -14.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 53.210 -27.850 -14.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 54.743 -28.312 -14.269 1.00 0.00 H new ATOM 402 N ASP A 28 54.232 -23.120 -14.445 1.00 0.00 N ATOM 403 CA ASP A 28 54.536 -21.979 -15.300 1.00 0.00 C ATOM 404 C ASP A 28 53.339 -21.622 -16.177 1.00 0.00 C ATOM 405 O ASP A 28 53.491 -21.329 -17.362 1.00 0.00 O ATOM 406 CB ASP A 28 55.754 -22.280 -16.175 1.00 0.00 C ATOM 407 CG ASP A 28 56.988 -22.604 -15.358 1.00 0.00 C ATOM 408 OD1 ASP A 28 57.245 -21.894 -14.363 1.00 0.00 O ATOM 409 OD2 ASP A 28 57.697 -23.569 -15.712 1.00 0.00 O ATOM 0 H ASP A 28 54.362 -24.028 -14.891 1.00 0.00 H new ATOM 0 HA ASP A 28 54.761 -21.126 -14.659 1.00 0.00 H new ATOM 0 HB2 ASP A 28 55.527 -23.119 -16.833 1.00 0.00 H new ATOM 0 HB3 ASP A 28 55.960 -21.421 -16.814 1.00 0.00 H new ATOM 414 N ASN A 29 52.150 -21.651 -15.585 1.00 0.00 N ATOM 415 CA ASN A 29 50.926 -21.333 -16.313 1.00 0.00 C ATOM 416 C ASN A 29 49.723 -21.322 -15.376 1.00 0.00 C ATOM 417 O ASN A 29 48.854 -20.456 -15.474 1.00 0.00 O ATOM 418 CB ASN A 29 50.701 -22.343 -17.440 1.00 0.00 C ATOM 419 CG ASN A 29 50.822 -21.714 -18.814 1.00 0.00 C ATOM 420 OD1 ASN A 29 51.827 -21.889 -19.503 1.00 0.00 O ATOM 421 ND2 ASN A 29 49.795 -20.975 -19.219 1.00 0.00 N ATOM 0 H ASN A 29 52.007 -21.891 -14.604 1.00 0.00 H new ATOM 0 HA ASN A 29 51.037 -20.338 -16.744 1.00 0.00 H new ATOM 0 HB2 ASN A 29 51.426 -23.152 -17.349 1.00 0.00 H new ATOM 0 HB3 ASN A 29 49.712 -22.788 -17.333 1.00 0.00 H new ATOM 0 HD21 ASN A 29 49.820 -20.526 -20.134 1.00 0.00 H new ATOM 0 HD22 ASN A 29 48.982 -20.857 -18.615 1.00 0.00 H new ATOM 428 N PHE A 30 49.679 -22.290 -14.466 1.00 0.00 N ATOM 429 CA PHE A 30 48.582 -22.393 -13.511 1.00 0.00 C ATOM 430 C PHE A 30 49.088 -22.868 -12.152 1.00 0.00 C ATOM 431 O PHE A 30 50.179 -23.426 -12.043 1.00 0.00 O ATOM 432 CB PHE A 30 47.511 -23.353 -14.033 1.00 0.00 C ATOM 433 CG PHE A 30 48.066 -24.659 -14.526 1.00 0.00 C ATOM 434 CD1 PHE A 30 48.446 -25.647 -13.632 1.00 0.00 C ATOM 435 CD2 PHE A 30 48.207 -24.899 -15.883 1.00 0.00 C ATOM 436 CE1 PHE A 30 48.956 -26.850 -14.081 1.00 0.00 C ATOM 437 CE2 PHE A 30 48.716 -26.101 -16.339 1.00 0.00 C ATOM 438 CZ PHE A 30 49.092 -27.077 -15.437 1.00 0.00 C ATOM 0 H PHE A 30 50.391 -23.014 -14.370 1.00 0.00 H new ATOM 0 HA PHE A 30 48.144 -21.402 -13.391 1.00 0.00 H new ATOM 0 HB2 PHE A 30 46.792 -23.550 -13.238 1.00 0.00 H new ATOM 0 HB3 PHE A 30 46.965 -22.870 -14.844 1.00 0.00 H new ATOM 0 HD1 PHE A 30 48.342 -25.475 -12.571 1.00 0.00 H new ATOM 0 HD2 PHE A 30 47.916 -24.139 -16.593 1.00 0.00 H new ATOM 0 HE1 PHE A 30 49.248 -27.612 -13.373 1.00 0.00 H new ATOM 0 HE2 PHE A 30 48.819 -26.277 -17.400 1.00 0.00 H new ATOM 0 HZ PHE A 30 49.492 -28.016 -15.791 1.00 0.00 H new ATOM 448 N GLY A 31 48.285 -22.641 -11.116 1.00 0.00 N ATOM 449 CA GLY A 31 48.668 -23.051 -9.778 1.00 0.00 C ATOM 450 C GLY A 31 47.579 -23.843 -9.081 1.00 0.00 C ATOM 451 O GLY A 31 46.515 -24.085 -9.651 1.00 0.00 O ATOM 0 H GLY A 31 47.377 -22.181 -11.180 1.00 0.00 H new ATOM 0 HA2 GLY A 31 49.574 -23.654 -9.831 1.00 0.00 H new ATOM 0 HA3 GLY A 31 48.907 -22.168 -9.185 1.00 0.00 H new ATOM 455 N PHE A 32 47.845 -24.249 -7.844 1.00 0.00 N ATOM 456 CA PHE A 32 46.881 -25.021 -7.068 1.00 0.00 C ATOM 457 C PHE A 32 46.836 -24.539 -5.621 1.00 0.00 C ATOM 458 O PHE A 32 47.757 -23.872 -5.149 1.00 0.00 O ATOM 459 CB PHE A 32 47.234 -26.509 -7.112 1.00 0.00 C ATOM 460 CG PHE A 32 46.984 -27.146 -8.449 1.00 0.00 C ATOM 461 CD1 PHE A 32 47.880 -26.974 -9.491 1.00 0.00 C ATOM 462 CD2 PHE A 32 45.852 -27.917 -8.663 1.00 0.00 C ATOM 463 CE1 PHE A 32 47.652 -27.558 -10.723 1.00 0.00 C ATOM 464 CE2 PHE A 32 45.619 -28.504 -9.893 1.00 0.00 C ATOM 465 CZ PHE A 32 46.520 -28.325 -10.923 1.00 0.00 C ATOM 0 H PHE A 32 48.720 -24.056 -7.357 1.00 0.00 H new ATOM 0 HA PHE A 32 45.896 -24.875 -7.511 1.00 0.00 H new ATOM 0 HB2 PHE A 32 48.285 -26.633 -6.851 1.00 0.00 H new ATOM 0 HB3 PHE A 32 46.653 -27.034 -6.354 1.00 0.00 H new ATOM 0 HD1 PHE A 32 48.767 -26.377 -9.339 1.00 0.00 H new ATOM 0 HD2 PHE A 32 45.144 -28.061 -7.860 1.00 0.00 H new ATOM 0 HE1 PHE A 32 48.358 -27.415 -11.528 1.00 0.00 H new ATOM 0 HE2 PHE A 32 44.733 -29.102 -10.048 1.00 0.00 H new ATOM 0 HZ PHE A 32 46.341 -28.784 -11.884 1.00 0.00 H new ATOM 475 N ILE A 33 45.758 -24.882 -4.923 1.00 0.00 N ATOM 476 CA ILE A 33 45.594 -24.485 -3.530 1.00 0.00 C ATOM 477 C ILE A 33 45.089 -25.648 -2.684 1.00 0.00 C ATOM 478 O ILE A 33 43.982 -26.145 -2.891 1.00 0.00 O ATOM 479 CB ILE A 33 44.616 -23.303 -3.394 1.00 0.00 C ATOM 480 CG1 ILE A 33 45.107 -22.109 -4.214 1.00 0.00 C ATOM 481 CG2 ILE A 33 44.452 -22.917 -1.931 1.00 0.00 C ATOM 482 CD1 ILE A 33 44.047 -21.054 -4.440 1.00 0.00 C ATOM 0 H ILE A 33 44.986 -25.433 -5.299 1.00 0.00 H new ATOM 0 HA ILE A 33 46.576 -24.177 -3.171 1.00 0.00 H new ATOM 0 HB ILE A 33 43.644 -23.609 -3.780 1.00 0.00 H new ATOM 0 HG12 ILE A 33 45.958 -21.655 -3.706 1.00 0.00 H new ATOM 0 HG13 ILE A 33 45.466 -22.465 -5.180 1.00 0.00 H new ATOM 0 HG21 ILE A 33 43.758 -22.080 -1.851 1.00 0.00 H new ATOM 0 HG22 ILE A 33 44.061 -23.767 -1.372 1.00 0.00 H new ATOM 0 HG23 ILE A 33 45.419 -22.627 -1.521 1.00 0.00 H new ATOM 0 HD11 ILE A 33 44.466 -20.238 -5.028 1.00 0.00 H new ATOM 0 HD12 ILE A 33 43.205 -21.493 -4.976 1.00 0.00 H new ATOM 0 HD13 ILE A 33 43.705 -20.670 -3.479 1.00 0.00 H new ATOM 494 N GLU A 34 45.907 -26.077 -1.728 1.00 0.00 N ATOM 495 CA GLU A 34 45.543 -27.181 -0.849 1.00 0.00 C ATOM 496 C GLU A 34 44.755 -26.679 0.358 1.00 0.00 C ATOM 497 O GLU A 34 45.220 -25.817 1.103 1.00 0.00 O ATOM 498 CB GLU A 34 46.796 -27.925 -0.380 1.00 0.00 C ATOM 499 CG GLU A 34 46.718 -29.430 -0.572 1.00 0.00 C ATOM 500 CD GLU A 34 48.056 -30.113 -0.370 1.00 0.00 C ATOM 501 OE1 GLU A 34 48.443 -30.328 0.798 1.00 0.00 O ATOM 502 OE2 GLU A 34 48.716 -30.434 -1.381 1.00 0.00 O ATOM 0 H GLU A 34 46.827 -25.676 -1.543 1.00 0.00 H new ATOM 0 HA GLU A 34 44.912 -27.867 -1.414 1.00 0.00 H new ATOM 0 HB2 GLU A 34 47.660 -27.542 -0.923 1.00 0.00 H new ATOM 0 HB3 GLU A 34 46.962 -27.710 0.676 1.00 0.00 H new ATOM 0 HG2 GLU A 34 45.993 -29.845 0.128 1.00 0.00 H new ATOM 0 HG3 GLU A 34 46.352 -29.646 -1.576 1.00 0.00 H new ATOM 509 N THR A 35 43.557 -27.225 0.543 1.00 0.00 N ATOM 510 CA THR A 35 42.702 -26.833 1.657 1.00 0.00 C ATOM 511 C THR A 35 43.308 -27.255 2.990 1.00 0.00 C ATOM 512 O THR A 35 44.017 -28.258 3.071 1.00 0.00 O ATOM 513 CB THR A 35 41.295 -27.446 1.529 1.00 0.00 C ATOM 514 OG1 THR A 35 41.394 -28.853 1.285 1.00 0.00 O ATOM 515 CG2 THR A 35 40.517 -26.784 0.401 1.00 0.00 C ATOM 0 H THR A 35 43.157 -27.940 -0.064 1.00 0.00 H new ATOM 0 HA THR A 35 42.621 -25.746 1.625 1.00 0.00 H new ATOM 0 HB THR A 35 40.762 -27.277 2.465 1.00 0.00 H new ATOM 0 HG1 THR A 35 41.496 -29.012 0.323 1.00 0.00 H new ATOM 0 HG21 THR A 35 39.526 -27.233 0.330 1.00 0.00 H new ATOM 0 HG22 THR A 35 40.418 -25.718 0.604 1.00 0.00 H new ATOM 0 HG23 THR A 35 41.049 -26.926 -0.540 1.00 0.00 H new ATOM 523 N ALA A 36 43.025 -26.483 4.035 1.00 0.00 N ATOM 524 CA ALA A 36 43.540 -26.780 5.366 1.00 0.00 C ATOM 525 C ALA A 36 43.150 -28.187 5.805 1.00 0.00 C ATOM 526 O ALA A 36 43.934 -28.887 6.445 1.00 0.00 O ATOM 527 CB ALA A 36 43.034 -25.753 6.368 1.00 0.00 C ATOM 0 H ALA A 36 42.442 -25.648 3.985 1.00 0.00 H new ATOM 0 HA ALA A 36 44.628 -26.729 5.327 1.00 0.00 H new ATOM 0 HB1 ALA A 36 43.426 -25.987 7.358 1.00 0.00 H new ATOM 0 HB2 ALA A 36 43.368 -24.759 6.071 1.00 0.00 H new ATOM 0 HB3 ALA A 36 41.945 -25.777 6.394 1.00 0.00 H new ATOM 533 N ASN A 37 41.934 -28.595 5.456 1.00 0.00 N ATOM 534 CA ASN A 37 41.440 -29.920 5.815 1.00 0.00 C ATOM 535 C ASN A 37 42.164 -31.004 5.022 1.00 0.00 C ATOM 536 O ASN A 37 42.239 -32.156 5.451 1.00 0.00 O ATOM 537 CB ASN A 37 39.933 -30.010 5.567 1.00 0.00 C ATOM 538 CG ASN A 37 39.124 -29.376 6.682 1.00 0.00 C ATOM 539 OD1 ASN A 37 39.233 -28.178 6.940 1.00 0.00 O ATOM 540 ND2 ASN A 37 38.307 -30.182 7.351 1.00 0.00 N ATOM 0 H ASN A 37 41.273 -28.028 4.925 1.00 0.00 H new ATOM 0 HA ASN A 37 41.636 -30.079 6.875 1.00 0.00 H new ATOM 0 HB2 ASN A 37 39.693 -29.519 4.624 1.00 0.00 H new ATOM 0 HB3 ASN A 37 39.646 -31.057 5.464 1.00 0.00 H new ATOM 0 HD21 ASN A 37 37.738 -29.813 8.113 1.00 0.00 H new ATOM 0 HD22 ASN A 37 38.249 -31.170 7.103 1.00 0.00 H new ATOM 547 N HIS A 38 42.695 -30.627 3.864 1.00 0.00 N ATOM 548 CA HIS A 38 43.414 -31.566 3.010 1.00 0.00 C ATOM 549 C HIS A 38 42.489 -32.681 2.530 1.00 0.00 C ATOM 550 O HIS A 38 42.244 -33.650 3.249 1.00 0.00 O ATOM 551 CB HIS A 38 44.604 -32.163 3.763 1.00 0.00 C ATOM 552 CG HIS A 38 45.561 -32.902 2.879 1.00 0.00 C ATOM 553 ND1 HIS A 38 45.317 -34.173 2.401 1.00 0.00 N ATOM 554 CD2 HIS A 38 46.769 -32.542 2.385 1.00 0.00 C ATOM 555 CE1 HIS A 38 46.334 -34.562 1.654 1.00 0.00 C ATOM 556 NE2 HIS A 38 47.228 -33.591 1.627 1.00 0.00 N ATOM 0 H HIS A 38 42.641 -29.678 3.495 1.00 0.00 H new ATOM 0 HA HIS A 38 43.780 -31.022 2.139 1.00 0.00 H new ATOM 0 HB2 HIS A 38 45.139 -31.363 4.275 1.00 0.00 H new ATOM 0 HB3 HIS A 38 44.234 -32.841 4.532 1.00 0.00 H new ATOM 0 HD2 HIS A 38 47.277 -31.604 2.555 1.00 0.00 H new ATOM 0 HE1 HIS A 38 46.420 -35.514 1.150 1.00 0.00 H new ATOM 0 HE2 HIS A 38 48.115 -33.616 1.125 1.00 0.00 H new ATOM 564 N ASP A 39 41.979 -32.536 1.312 1.00 0.00 N ATOM 565 CA ASP A 39 41.082 -33.531 0.736 1.00 0.00 C ATOM 566 C ASP A 39 40.726 -33.173 -0.703 1.00 0.00 C ATOM 567 O ASP A 39 40.622 -34.046 -1.565 1.00 0.00 O ATOM 568 CB ASP A 39 39.809 -33.648 1.576 1.00 0.00 C ATOM 569 CG ASP A 39 38.797 -34.596 0.964 1.00 0.00 C ATOM 570 OD1 ASP A 39 39.214 -35.515 0.228 1.00 0.00 O ATOM 571 OD2 ASP A 39 37.588 -34.420 1.221 1.00 0.00 O ATOM 0 H ASP A 39 42.171 -31.739 0.705 1.00 0.00 H new ATOM 0 HA ASP A 39 41.597 -34.492 0.735 1.00 0.00 H new ATOM 0 HB2 ASP A 39 40.068 -33.994 2.577 1.00 0.00 H new ATOM 0 HB3 ASP A 39 39.358 -32.662 1.687 1.00 0.00 H new ATOM 576 N LYS A 40 40.539 -31.882 -0.957 1.00 0.00 N ATOM 577 CA LYS A 40 40.194 -31.406 -2.292 1.00 0.00 C ATOM 578 C LYS A 40 41.186 -30.348 -2.765 1.00 0.00 C ATOM 579 O LYS A 40 41.643 -29.518 -1.980 1.00 0.00 O ATOM 580 CB LYS A 40 38.776 -30.831 -2.300 1.00 0.00 C ATOM 581 CG LYS A 40 38.215 -30.617 -3.695 1.00 0.00 C ATOM 582 CD LYS A 40 37.811 -29.169 -3.918 1.00 0.00 C ATOM 583 CE LYS A 40 36.450 -28.870 -3.306 1.00 0.00 C ATOM 584 NZ LYS A 40 36.363 -27.471 -2.805 1.00 0.00 N ATOM 0 H LYS A 40 40.621 -31.146 -0.255 1.00 0.00 H new ATOM 0 HA LYS A 40 40.240 -32.253 -2.976 1.00 0.00 H new ATOM 0 HB2 LYS A 40 38.117 -31.504 -1.752 1.00 0.00 H new ATOM 0 HB3 LYS A 40 38.775 -29.880 -1.767 1.00 0.00 H new ATOM 0 HG2 LYS A 40 38.960 -30.906 -4.436 1.00 0.00 H new ATOM 0 HG3 LYS A 40 37.350 -31.264 -3.844 1.00 0.00 H new ATOM 0 HD2 LYS A 40 38.561 -28.509 -3.481 1.00 0.00 H new ATOM 0 HD3 LYS A 40 37.785 -28.958 -4.987 1.00 0.00 H new ATOM 0 HE2 LYS A 40 35.672 -29.038 -4.051 1.00 0.00 H new ATOM 0 HE3 LYS A 40 36.261 -29.562 -2.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 35.421 -27.307 -2.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 37.089 -27.318 -2.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 36.518 -26.810 -3.593 1.00 0.00 H new ATOM 598 N GLU A 41 41.514 -30.385 -4.053 1.00 0.00 N ATOM 599 CA GLU A 41 42.451 -29.428 -4.630 1.00 0.00 C ATOM 600 C GLU A 41 41.712 -28.348 -5.415 1.00 0.00 C ATOM 601 O GLU A 41 40.562 -28.534 -5.814 1.00 0.00 O ATOM 602 CB GLU A 41 43.449 -30.145 -5.541 1.00 0.00 C ATOM 603 CG GLU A 41 44.701 -30.618 -4.821 1.00 0.00 C ATOM 604 CD GLU A 41 45.970 -30.043 -5.418 1.00 0.00 C ATOM 605 OE1 GLU A 41 46.209 -30.259 -6.625 1.00 0.00 O ATOM 606 OE2 GLU A 41 46.726 -29.378 -4.679 1.00 0.00 O ATOM 0 H GLU A 41 41.145 -31.067 -4.716 1.00 0.00 H new ATOM 0 HA GLU A 41 42.993 -28.951 -3.814 1.00 0.00 H new ATOM 0 HB2 GLU A 41 42.958 -31.003 -5.999 1.00 0.00 H new ATOM 0 HB3 GLU A 41 43.737 -29.473 -6.350 1.00 0.00 H new ATOM 0 HG2 GLU A 41 44.639 -30.337 -3.770 1.00 0.00 H new ATOM 0 HG3 GLU A 41 44.747 -31.706 -4.858 1.00 0.00 H new ATOM 613 N ILE A 42 42.381 -27.221 -5.632 1.00 0.00 N ATOM 614 CA ILE A 42 41.789 -26.112 -6.370 1.00 0.00 C ATOM 615 C ILE A 42 42.603 -25.784 -7.617 1.00 0.00 C ATOM 616 O ILE A 42 43.820 -25.970 -7.643 1.00 0.00 O ATOM 617 CB ILE A 42 41.679 -24.849 -5.495 1.00 0.00 C ATOM 618 CG1 ILE A 42 41.033 -25.188 -4.150 1.00 0.00 C ATOM 619 CG2 ILE A 42 40.881 -23.773 -6.216 1.00 0.00 C ATOM 620 CD1 ILE A 42 39.616 -25.702 -4.273 1.00 0.00 C ATOM 0 H ILE A 42 43.333 -27.052 -5.307 1.00 0.00 H new ATOM 0 HA ILE A 42 40.789 -26.428 -6.665 1.00 0.00 H new ATOM 0 HB ILE A 42 42.682 -24.466 -5.308 1.00 0.00 H new ATOM 0 HG12 ILE A 42 41.640 -25.938 -3.643 1.00 0.00 H new ATOM 0 HG13 ILE A 42 41.035 -24.298 -3.521 1.00 0.00 H new ATOM 0 HG21 ILE A 42 40.812 -22.887 -5.585 1.00 0.00 H new ATOM 0 HG22 ILE A 42 41.379 -23.515 -7.150 1.00 0.00 H new ATOM 0 HG23 ILE A 42 39.879 -24.145 -6.430 1.00 0.00 H new ATOM 0 HD11 ILE A 42 39.221 -25.922 -3.281 1.00 0.00 H new ATOM 0 HD12 ILE A 42 38.995 -24.945 -4.751 1.00 0.00 H new ATOM 0 HD13 ILE A 42 39.609 -26.610 -4.876 1.00 0.00 H new ATOM 632 N PHE A 43 41.924 -25.293 -8.648 1.00 0.00 N ATOM 633 CA PHE A 43 42.584 -24.937 -9.898 1.00 0.00 C ATOM 634 C PHE A 43 42.260 -23.500 -10.295 1.00 0.00 C ATOM 635 O PHE A 43 41.109 -23.166 -10.578 1.00 0.00 O ATOM 636 CB PHE A 43 42.160 -25.894 -11.014 1.00 0.00 C ATOM 637 CG PHE A 43 42.786 -25.582 -12.343 1.00 0.00 C ATOM 638 CD1 PHE A 43 44.040 -26.075 -12.666 1.00 0.00 C ATOM 639 CD2 PHE A 43 42.121 -24.795 -13.269 1.00 0.00 C ATOM 640 CE1 PHE A 43 44.618 -25.788 -13.888 1.00 0.00 C ATOM 641 CE2 PHE A 43 42.694 -24.505 -14.493 1.00 0.00 C ATOM 642 CZ PHE A 43 43.944 -25.003 -14.803 1.00 0.00 C ATOM 0 H PHE A 43 40.917 -25.133 -8.642 1.00 0.00 H new ATOM 0 HA PHE A 43 43.660 -25.019 -9.747 1.00 0.00 H new ATOM 0 HB2 PHE A 43 42.423 -26.912 -10.728 1.00 0.00 H new ATOM 0 HB3 PHE A 43 41.075 -25.862 -11.116 1.00 0.00 H new ATOM 0 HD1 PHE A 43 44.571 -26.690 -11.955 1.00 0.00 H new ATOM 0 HD2 PHE A 43 41.143 -24.403 -13.032 1.00 0.00 H new ATOM 0 HE1 PHE A 43 45.596 -26.177 -14.127 1.00 0.00 H new ATOM 0 HE2 PHE A 43 42.165 -23.890 -15.206 1.00 0.00 H new ATOM 0 HZ PHE A 43 44.394 -24.779 -15.759 1.00 0.00 H new ATOM 652 N PHE A 44 43.284 -22.652 -10.314 1.00 0.00 N ATOM 653 CA PHE A 44 43.109 -21.250 -10.674 1.00 0.00 C ATOM 654 C PHE A 44 44.137 -20.825 -11.718 1.00 0.00 C ATOM 655 O PHE A 44 45.326 -21.119 -11.592 1.00 0.00 O ATOM 656 CB PHE A 44 43.229 -20.364 -9.433 1.00 0.00 C ATOM 657 CG PHE A 44 44.624 -20.290 -8.881 1.00 0.00 C ATOM 658 CD1 PHE A 44 45.507 -19.317 -9.322 1.00 0.00 C ATOM 659 CD2 PHE A 44 45.053 -21.194 -7.922 1.00 0.00 C ATOM 660 CE1 PHE A 44 46.791 -19.248 -8.817 1.00 0.00 C ATOM 661 CE2 PHE A 44 46.336 -21.129 -7.413 1.00 0.00 C ATOM 662 CZ PHE A 44 47.206 -20.154 -7.860 1.00 0.00 C ATOM 0 H PHE A 44 44.243 -22.912 -10.084 1.00 0.00 H new ATOM 0 HA PHE A 44 42.113 -21.132 -11.101 1.00 0.00 H new ATOM 0 HB2 PHE A 44 42.891 -19.358 -9.681 1.00 0.00 H new ATOM 0 HB3 PHE A 44 42.561 -20.743 -8.660 1.00 0.00 H new ATOM 0 HD1 PHE A 44 45.188 -18.605 -10.069 1.00 0.00 H new ATOM 0 HD2 PHE A 44 44.377 -21.958 -7.568 1.00 0.00 H new ATOM 0 HE1 PHE A 44 47.470 -18.486 -9.170 1.00 0.00 H new ATOM 0 HE2 PHE A 44 46.658 -21.840 -6.666 1.00 0.00 H new ATOM 0 HZ PHE A 44 48.209 -20.100 -7.462 1.00 0.00 H new ATOM 672 N HIS A 45 43.670 -20.130 -12.751 1.00 0.00 N ATOM 673 CA HIS A 45 44.548 -19.663 -13.818 1.00 0.00 C ATOM 674 C HIS A 45 45.287 -18.396 -13.398 1.00 0.00 C ATOM 675 O HIS A 45 44.796 -17.622 -12.576 1.00 0.00 O ATOM 676 CB HIS A 45 43.743 -19.399 -15.091 1.00 0.00 C ATOM 677 CG HIS A 45 44.443 -19.832 -16.342 1.00 0.00 C ATOM 678 ND1 HIS A 45 45.529 -19.163 -16.867 1.00 0.00 N ATOM 679 CD2 HIS A 45 44.208 -20.873 -17.174 1.00 0.00 C ATOM 680 CE1 HIS A 45 45.930 -19.773 -17.967 1.00 0.00 C ATOM 681 NE2 HIS A 45 45.145 -20.815 -18.175 1.00 0.00 N ATOM 0 H HIS A 45 42.689 -19.878 -12.871 1.00 0.00 H new ATOM 0 HA HIS A 45 45.283 -20.443 -14.017 1.00 0.00 H new ATOM 0 HB2 HIS A 45 42.787 -19.918 -15.021 1.00 0.00 H new ATOM 0 HB3 HIS A 45 43.523 -18.334 -15.158 1.00 0.00 H new ATOM 0 HD2 HIS A 45 43.428 -21.612 -17.070 1.00 0.00 H new ATOM 0 HE1 HIS A 45 46.759 -19.472 -18.591 1.00 0.00 H new ATOM 0 HE2 HIS A 45 45.223 -21.470 -18.953 1.00 0.00 H new ATOM 689 N TYR A 46 46.470 -18.191 -13.966 1.00 0.00 N ATOM 690 CA TYR A 46 47.278 -17.020 -13.649 1.00 0.00 C ATOM 691 C TYR A 46 46.533 -15.734 -13.992 1.00 0.00 C ATOM 692 O TYR A 46 46.614 -14.744 -13.265 1.00 0.00 O ATOM 693 CB TYR A 46 48.606 -17.070 -14.406 1.00 0.00 C ATOM 694 CG TYR A 46 49.721 -17.733 -13.630 1.00 0.00 C ATOM 695 CD1 TYR A 46 49.513 -18.937 -12.968 1.00 0.00 C ATOM 696 CD2 TYR A 46 50.983 -17.156 -13.557 1.00 0.00 C ATOM 697 CE1 TYR A 46 50.529 -19.547 -12.257 1.00 0.00 C ATOM 698 CE2 TYR A 46 52.005 -17.759 -12.849 1.00 0.00 C ATOM 699 CZ TYR A 46 51.773 -18.954 -12.201 1.00 0.00 C ATOM 700 OH TYR A 46 52.788 -19.557 -11.494 1.00 0.00 O ATOM 0 H TYR A 46 46.891 -18.821 -14.649 1.00 0.00 H new ATOM 0 HA TYR A 46 47.477 -17.028 -12.577 1.00 0.00 H new ATOM 0 HB2 TYR A 46 48.460 -17.605 -15.344 1.00 0.00 H new ATOM 0 HB3 TYR A 46 48.907 -16.054 -14.662 1.00 0.00 H new ATOM 0 HD1 TYR A 46 48.540 -19.404 -13.010 1.00 0.00 H new ATOM 0 HD2 TYR A 46 51.168 -16.220 -14.063 1.00 0.00 H new ATOM 0 HE1 TYR A 46 50.350 -20.483 -11.748 1.00 0.00 H new ATOM 0 HE2 TYR A 46 52.980 -17.297 -12.803 1.00 0.00 H new ATOM 0 HH TYR A 46 53.143 -20.311 -12.010 1.00 0.00 H new ATOM 710 N SER A 47 45.806 -15.758 -15.104 1.00 0.00 N ATOM 711 CA SER A 47 45.047 -14.594 -15.547 1.00 0.00 C ATOM 712 C SER A 47 44.002 -14.200 -14.508 1.00 0.00 C ATOM 713 O SER A 47 43.675 -13.023 -14.357 1.00 0.00 O ATOM 714 CB SER A 47 44.368 -14.881 -16.887 1.00 0.00 C ATOM 715 OG SER A 47 44.267 -16.275 -17.120 1.00 0.00 O ATOM 0 H SER A 47 45.726 -16.571 -15.715 1.00 0.00 H new ATOM 0 HA SER A 47 45.742 -13.763 -15.671 1.00 0.00 H new ATOM 0 HB2 SER A 47 43.374 -14.435 -16.897 1.00 0.00 H new ATOM 0 HB3 SER A 47 44.935 -14.415 -17.693 1.00 0.00 H new ATOM 0 HG SER A 47 43.828 -16.432 -17.982 1.00 0.00 H new ATOM 721 N GLU A 48 43.480 -15.194 -13.796 1.00 0.00 N ATOM 722 CA GLU A 48 42.471 -14.951 -12.772 1.00 0.00 C ATOM 723 C GLU A 48 43.097 -14.330 -11.527 1.00 0.00 C ATOM 724 O GLU A 48 42.433 -13.618 -10.773 1.00 0.00 O ATOM 725 CB GLU A 48 41.763 -16.256 -12.403 1.00 0.00 C ATOM 726 CG GLU A 48 41.107 -16.948 -13.586 1.00 0.00 C ATOM 727 CD GLU A 48 40.592 -18.332 -13.240 1.00 0.00 C ATOM 728 OE1 GLU A 48 40.622 -18.695 -12.046 1.00 0.00 O ATOM 729 OE2 GLU A 48 40.159 -19.051 -14.165 1.00 0.00 O ATOM 0 H GLU A 48 43.739 -16.174 -13.909 1.00 0.00 H new ATOM 0 HA GLU A 48 41.740 -14.251 -13.177 1.00 0.00 H new ATOM 0 HB2 GLU A 48 42.485 -16.936 -11.950 1.00 0.00 H new ATOM 0 HB3 GLU A 48 41.004 -16.047 -11.649 1.00 0.00 H new ATOM 0 HG2 GLU A 48 40.280 -16.336 -13.947 1.00 0.00 H new ATOM 0 HG3 GLU A 48 41.826 -17.025 -14.401 1.00 0.00 H new ATOM 736 N PHE A 49 44.380 -14.605 -11.317 1.00 0.00 N ATOM 737 CA PHE A 49 45.097 -14.075 -10.162 1.00 0.00 C ATOM 738 C PHE A 49 45.453 -12.606 -10.371 1.00 0.00 C ATOM 739 O PHE A 49 45.748 -12.180 -11.487 1.00 0.00 O ATOM 740 CB PHE A 49 46.368 -14.889 -9.907 1.00 0.00 C ATOM 741 CG PHE A 49 47.013 -14.593 -8.584 1.00 0.00 C ATOM 742 CD1 PHE A 49 47.851 -13.500 -8.436 1.00 0.00 C ATOM 743 CD2 PHE A 49 46.782 -15.409 -7.488 1.00 0.00 C ATOM 744 CE1 PHE A 49 48.447 -13.224 -7.219 1.00 0.00 C ATOM 745 CE2 PHE A 49 47.374 -15.138 -6.269 1.00 0.00 C ATOM 746 CZ PHE A 49 48.208 -14.045 -6.134 1.00 0.00 C ATOM 0 H PHE A 49 44.945 -15.192 -11.931 1.00 0.00 H new ATOM 0 HA PHE A 49 44.444 -14.152 -9.293 1.00 0.00 H new ATOM 0 HB2 PHE A 49 46.126 -15.951 -9.955 1.00 0.00 H new ATOM 0 HB3 PHE A 49 47.084 -14.689 -10.704 1.00 0.00 H new ATOM 0 HD1 PHE A 49 48.041 -12.855 -9.281 1.00 0.00 H new ATOM 0 HD2 PHE A 49 46.132 -16.266 -7.588 1.00 0.00 H new ATOM 0 HE1 PHE A 49 49.098 -12.368 -7.117 1.00 0.00 H new ATOM 0 HE2 PHE A 49 47.185 -15.781 -5.422 1.00 0.00 H new ATOM 0 HZ PHE A 49 48.672 -13.833 -5.182 1.00 0.00 H new ATOM 756 N SER A 50 45.422 -11.837 -9.287 1.00 0.00 N ATOM 757 CA SER A 50 45.737 -10.415 -9.351 1.00 0.00 C ATOM 758 C SER A 50 46.904 -10.075 -8.429 1.00 0.00 C ATOM 759 O SER A 50 46.733 -9.931 -7.219 1.00 0.00 O ATOM 760 CB SER A 50 44.512 -9.582 -8.969 1.00 0.00 C ATOM 761 OG SER A 50 44.331 -8.500 -9.866 1.00 0.00 O ATOM 0 H SER A 50 45.182 -12.175 -8.355 1.00 0.00 H new ATOM 0 HA SER A 50 46.024 -10.178 -10.375 1.00 0.00 H new ATOM 0 HB2 SER A 50 43.624 -10.214 -8.972 1.00 0.00 H new ATOM 0 HB3 SER A 50 44.629 -9.202 -7.954 1.00 0.00 H new ATOM 0 HG SER A 50 43.541 -7.984 -9.601 1.00 0.00 H new ATOM 767 N GLY A 51 48.093 -9.948 -9.011 1.00 0.00 N ATOM 768 CA GLY A 51 49.272 -9.626 -8.229 1.00 0.00 C ATOM 769 C GLY A 51 50.514 -10.332 -8.735 1.00 0.00 C ATOM 770 O GLY A 51 50.520 -10.878 -9.838 1.00 0.00 O ATOM 0 H GLY A 51 48.260 -10.063 -10.011 1.00 0.00 H new ATOM 0 HA2 GLY A 51 49.436 -8.549 -8.251 1.00 0.00 H new ATOM 0 HA3 GLY A 51 49.100 -9.901 -7.188 1.00 0.00 H new ATOM 774 N ASP A 52 51.570 -10.319 -7.929 1.00 0.00 N ATOM 775 CA ASP A 52 52.825 -10.962 -8.302 1.00 0.00 C ATOM 776 C ASP A 52 52.722 -12.477 -8.159 1.00 0.00 C ATOM 777 O ASP A 52 53.297 -13.065 -7.242 1.00 0.00 O ATOM 778 CB ASP A 52 53.970 -10.432 -7.439 1.00 0.00 C ATOM 779 CG ASP A 52 53.847 -8.946 -7.162 1.00 0.00 C ATOM 780 OD1 ASP A 52 54.164 -8.147 -8.067 1.00 0.00 O ATOM 781 OD2 ASP A 52 53.435 -8.584 -6.040 1.00 0.00 O ATOM 0 H ASP A 52 51.582 -9.870 -7.013 1.00 0.00 H new ATOM 0 HA ASP A 52 53.029 -10.727 -9.347 1.00 0.00 H new ATOM 0 HB2 ASP A 52 53.990 -10.974 -6.494 1.00 0.00 H new ATOM 0 HB3 ASP A 52 54.919 -10.628 -7.939 1.00 0.00 H new ATOM 786 N VAL A 53 51.985 -13.104 -9.070 1.00 0.00 N ATOM 787 CA VAL A 53 51.807 -14.551 -9.046 1.00 0.00 C ATOM 788 C VAL A 53 53.116 -15.272 -9.347 1.00 0.00 C ATOM 789 O VAL A 53 53.327 -16.405 -8.915 1.00 0.00 O ATOM 790 CB VAL A 53 50.740 -15.003 -10.060 1.00 0.00 C ATOM 791 CG1 VAL A 53 51.162 -14.642 -11.476 1.00 0.00 C ATOM 792 CG2 VAL A 53 50.485 -16.497 -9.936 1.00 0.00 C ATOM 0 H VAL A 53 51.501 -12.632 -9.834 1.00 0.00 H new ATOM 0 HA VAL A 53 51.475 -14.811 -8.041 1.00 0.00 H new ATOM 0 HB VAL A 53 49.810 -14.480 -9.839 1.00 0.00 H new ATOM 0 HG11 VAL A 53 50.396 -14.969 -12.179 1.00 0.00 H new ATOM 0 HG12 VAL A 53 51.288 -13.562 -11.554 1.00 0.00 H new ATOM 0 HG13 VAL A 53 52.105 -15.136 -11.712 1.00 0.00 H new ATOM 0 HG21 VAL A 53 49.728 -16.798 -10.660 1.00 0.00 H new ATOM 0 HG22 VAL A 53 51.409 -17.041 -10.129 1.00 0.00 H new ATOM 0 HG23 VAL A 53 50.134 -16.724 -8.929 1.00 0.00 H new ATOM 802 N ASP A 54 53.993 -14.606 -10.091 1.00 0.00 N ATOM 803 CA ASP A 54 55.284 -15.182 -10.450 1.00 0.00 C ATOM 804 C ASP A 54 56.238 -15.160 -9.260 1.00 0.00 C ATOM 805 O ASP A 54 57.119 -16.012 -9.142 1.00 0.00 O ATOM 806 CB ASP A 54 55.897 -14.420 -11.625 1.00 0.00 C ATOM 807 CG ASP A 54 56.349 -13.025 -11.239 1.00 0.00 C ATOM 808 OD1 ASP A 54 55.504 -12.240 -10.761 1.00 0.00 O ATOM 809 OD2 ASP A 54 57.547 -12.719 -11.415 1.00 0.00 O ATOM 0 H ASP A 54 53.833 -13.667 -10.457 1.00 0.00 H new ATOM 0 HA ASP A 54 55.123 -16.219 -10.744 1.00 0.00 H new ATOM 0 HB2 ASP A 54 56.748 -14.980 -12.013 1.00 0.00 H new ATOM 0 HB3 ASP A 54 55.166 -14.352 -12.431 1.00 0.00 H new ATOM 814 N SER A 55 56.057 -14.180 -8.380 1.00 0.00 N ATOM 815 CA SER A 55 56.906 -14.044 -7.202 1.00 0.00 C ATOM 816 C SER A 55 56.244 -14.675 -5.981 1.00 0.00 C ATOM 817 O SER A 55 56.464 -14.244 -4.848 1.00 0.00 O ATOM 818 CB SER A 55 57.203 -12.568 -6.929 1.00 0.00 C ATOM 819 OG SER A 55 56.133 -11.952 -6.234 1.00 0.00 O ATOM 0 H SER A 55 55.330 -13.469 -8.461 1.00 0.00 H new ATOM 0 HA SER A 55 57.843 -14.566 -7.397 1.00 0.00 H new ATOM 0 HB2 SER A 55 58.119 -12.480 -6.344 1.00 0.00 H new ATOM 0 HB3 SER A 55 57.376 -12.048 -7.871 1.00 0.00 H new ATOM 0 HG SER A 55 56.100 -12.293 -5.316 1.00 0.00 H new ATOM 825 N LEU A 56 55.432 -15.699 -6.219 1.00 0.00 N ATOM 826 CA LEU A 56 54.737 -16.392 -5.139 1.00 0.00 C ATOM 827 C LEU A 56 55.608 -17.497 -4.552 1.00 0.00 C ATOM 828 O LEU A 56 56.586 -17.922 -5.166 1.00 0.00 O ATOM 829 CB LEU A 56 53.420 -16.981 -5.649 1.00 0.00 C ATOM 830 CG LEU A 56 52.163 -16.160 -5.364 1.00 0.00 C ATOM 831 CD1 LEU A 56 50.941 -16.822 -5.983 1.00 0.00 C ATOM 832 CD2 LEU A 56 51.972 -15.980 -3.865 1.00 0.00 C ATOM 0 H LEU A 56 55.238 -16.068 -7.150 1.00 0.00 H new ATOM 0 HA LEU A 56 54.524 -15.667 -4.353 1.00 0.00 H new ATOM 0 HB2 LEU A 56 53.501 -17.121 -6.727 1.00 0.00 H new ATOM 0 HB3 LEU A 56 53.292 -17.969 -5.207 1.00 0.00 H new ATOM 0 HG LEU A 56 52.285 -15.175 -5.815 1.00 0.00 H new ATOM 0 HD11 LEU A 56 50.056 -16.223 -5.770 1.00 0.00 H new ATOM 0 HD12 LEU A 56 51.076 -16.899 -7.062 1.00 0.00 H new ATOM 0 HD13 LEU A 56 50.815 -17.819 -5.562 1.00 0.00 H new ATOM 0 HD21 LEU A 56 51.072 -15.393 -3.681 1.00 0.00 H new ATOM 0 HD22 LEU A 56 51.872 -16.956 -3.391 1.00 0.00 H new ATOM 0 HD23 LEU A 56 52.835 -15.461 -3.448 1.00 0.00 H new ATOM 844 N GLU A 57 55.244 -17.961 -3.360 1.00 0.00 N ATOM 845 CA GLU A 57 55.992 -19.018 -2.691 1.00 0.00 C ATOM 846 C GLU A 57 55.054 -20.102 -2.168 1.00 0.00 C ATOM 847 O GLU A 57 53.859 -19.867 -1.982 1.00 0.00 O ATOM 848 CB GLU A 57 56.814 -18.440 -1.537 1.00 0.00 C ATOM 849 CG GLU A 57 58.133 -17.826 -1.977 1.00 0.00 C ATOM 850 CD GLU A 57 59.280 -18.184 -1.053 1.00 0.00 C ATOM 851 OE1 GLU A 57 59.155 -17.948 0.167 1.00 0.00 O ATOM 852 OE2 GLU A 57 60.304 -18.699 -1.550 1.00 0.00 O ATOM 0 H GLU A 57 54.436 -17.621 -2.839 1.00 0.00 H new ATOM 0 HA GLU A 57 56.667 -19.467 -3.420 1.00 0.00 H new ATOM 0 HB2 GLU A 57 56.222 -17.681 -1.025 1.00 0.00 H new ATOM 0 HB3 GLU A 57 57.014 -19.230 -0.813 1.00 0.00 H new ATOM 0 HG2 GLU A 57 58.367 -18.162 -2.987 1.00 0.00 H new ATOM 0 HG3 GLU A 57 58.029 -16.742 -2.018 1.00 0.00 H new ATOM 859 N LEU A 58 55.602 -21.288 -1.933 1.00 0.00 N ATOM 860 CA LEU A 58 54.815 -22.410 -1.432 1.00 0.00 C ATOM 861 C LEU A 58 54.517 -22.244 0.055 1.00 0.00 C ATOM 862 O LEU A 58 55.428 -22.093 0.868 1.00 0.00 O ATOM 863 CB LEU A 58 55.556 -23.726 -1.672 1.00 0.00 C ATOM 864 CG LEU A 58 56.040 -23.973 -3.101 1.00 0.00 C ATOM 865 CD1 LEU A 58 56.928 -25.206 -3.159 1.00 0.00 C ATOM 866 CD2 LEU A 58 54.856 -24.122 -4.046 1.00 0.00 C ATOM 0 H LEU A 58 56.589 -21.499 -2.081 1.00 0.00 H new ATOM 0 HA LEU A 58 53.869 -22.430 -1.974 1.00 0.00 H new ATOM 0 HB2 LEU A 58 56.419 -23.761 -1.007 1.00 0.00 H new ATOM 0 HB3 LEU A 58 54.899 -24.547 -1.385 1.00 0.00 H new ATOM 0 HG LEU A 58 56.628 -23.112 -3.419 1.00 0.00 H new ATOM 0 HD11 LEU A 58 57.263 -25.366 -4.184 1.00 0.00 H new ATOM 0 HD12 LEU A 58 57.794 -25.061 -2.513 1.00 0.00 H new ATOM 0 HD13 LEU A 58 56.365 -26.076 -2.822 1.00 0.00 H new ATOM 0 HD21 LEU A 58 55.219 -24.297 -5.059 1.00 0.00 H new ATOM 0 HD22 LEU A 58 54.242 -24.965 -3.730 1.00 0.00 H new ATOM 0 HD23 LEU A 58 54.259 -23.211 -4.027 1.00 0.00 H new ATOM 878 N GLY A 59 53.234 -22.277 0.403 1.00 0.00 N ATOM 879 CA GLY A 59 52.839 -22.131 1.792 1.00 0.00 C ATOM 880 C GLY A 59 52.146 -20.810 2.062 1.00 0.00 C ATOM 881 O GLY A 59 51.417 -20.674 3.044 1.00 0.00 O ATOM 0 H GLY A 59 52.462 -22.402 -0.252 1.00 0.00 H new ATOM 0 HA2 GLY A 59 52.173 -22.950 2.065 1.00 0.00 H new ATOM 0 HA3 GLY A 59 53.721 -22.212 2.428 1.00 0.00 H new ATOM 885 N ASP A 60 52.375 -19.835 1.190 1.00 0.00 N ATOM 886 CA ASP A 60 51.768 -18.517 1.340 1.00 0.00 C ATOM 887 C ASP A 60 50.246 -18.617 1.333 1.00 0.00 C ATOM 888 O ASP A 60 49.670 -19.427 0.607 1.00 0.00 O ATOM 889 CB ASP A 60 52.236 -17.586 0.220 1.00 0.00 C ATOM 890 CG ASP A 60 53.208 -16.532 0.712 1.00 0.00 C ATOM 891 OD1 ASP A 60 52.746 -15.465 1.168 1.00 0.00 O ATOM 892 OD2 ASP A 60 54.432 -16.774 0.642 1.00 0.00 O ATOM 0 H ASP A 60 52.976 -19.932 0.372 1.00 0.00 H new ATOM 0 HA ASP A 60 52.083 -18.105 2.299 1.00 0.00 H new ATOM 0 HB2 ASP A 60 52.710 -18.176 -0.564 1.00 0.00 H new ATOM 0 HB3 ASP A 60 51.371 -17.097 -0.228 1.00 0.00 H new ATOM 897 N MET A 61 49.600 -17.787 2.146 1.00 0.00 N ATOM 898 CA MET A 61 48.144 -17.782 2.232 1.00 0.00 C ATOM 899 C MET A 61 47.534 -16.996 1.077 1.00 0.00 C ATOM 900 O MET A 61 48.022 -15.926 0.714 1.00 0.00 O ATOM 901 CB MET A 61 47.694 -17.183 3.566 1.00 0.00 C ATOM 902 CG MET A 61 47.327 -18.227 4.608 1.00 0.00 C ATOM 903 SD MET A 61 48.120 -17.927 6.200 1.00 0.00 S ATOM 904 CE MET A 61 49.640 -18.853 6.001 1.00 0.00 C ATOM 0 H MET A 61 50.061 -17.110 2.754 1.00 0.00 H new ATOM 0 HA MET A 61 47.797 -18.813 2.169 1.00 0.00 H new ATOM 0 HB2 MET A 61 48.492 -16.553 3.960 1.00 0.00 H new ATOM 0 HB3 MET A 61 46.834 -16.536 3.393 1.00 0.00 H new ATOM 0 HG2 MET A 61 46.245 -18.237 4.741 1.00 0.00 H new ATOM 0 HG3 MET A 61 47.613 -19.214 4.244 1.00 0.00 H new ATOM 0 HE1 MET A 61 49.618 -19.731 6.646 1.00 0.00 H new ATOM 0 HE2 MET A 61 49.741 -19.168 4.962 1.00 0.00 H new ATOM 0 HE3 MET A 61 50.488 -18.224 6.273 1.00 0.00 H new ATOM 914 N VAL A 62 46.463 -17.534 0.501 1.00 0.00 N ATOM 915 CA VAL A 62 45.785 -16.882 -0.613 1.00 0.00 C ATOM 916 C VAL A 62 44.273 -16.895 -0.420 1.00 0.00 C ATOM 917 O VAL A 62 43.702 -17.893 0.018 1.00 0.00 O ATOM 918 CB VAL A 62 46.126 -17.561 -1.952 1.00 0.00 C ATOM 919 CG1 VAL A 62 47.579 -17.306 -2.326 1.00 0.00 C ATOM 920 CG2 VAL A 62 45.840 -19.054 -1.881 1.00 0.00 C ATOM 0 H VAL A 62 46.046 -18.420 0.788 1.00 0.00 H new ATOM 0 HA VAL A 62 46.136 -15.850 -0.637 1.00 0.00 H new ATOM 0 HB VAL A 62 45.494 -17.130 -2.729 1.00 0.00 H new ATOM 0 HG11 VAL A 62 47.801 -17.794 -3.275 1.00 0.00 H new ATOM 0 HG12 VAL A 62 47.747 -16.233 -2.421 1.00 0.00 H new ATOM 0 HG13 VAL A 62 48.230 -17.708 -1.550 1.00 0.00 H new ATOM 0 HG21 VAL A 62 46.087 -19.518 -2.836 1.00 0.00 H new ATOM 0 HG22 VAL A 62 46.444 -19.503 -1.093 1.00 0.00 H new ATOM 0 HG23 VAL A 62 44.784 -19.212 -1.663 1.00 0.00 H new ATOM 930 N GLU A 63 43.630 -15.779 -0.751 1.00 0.00 N ATOM 931 CA GLU A 63 42.183 -15.663 -0.613 1.00 0.00 C ATOM 932 C GLU A 63 41.491 -15.855 -1.960 1.00 0.00 C ATOM 933 O GLU A 63 41.896 -15.273 -2.967 1.00 0.00 O ATOM 934 CB GLU A 63 41.812 -14.299 -0.027 1.00 0.00 C ATOM 935 CG GLU A 63 40.830 -14.381 1.130 1.00 0.00 C ATOM 936 CD GLU A 63 39.793 -13.276 1.095 1.00 0.00 C ATOM 937 OE1 GLU A 63 40.059 -12.193 1.655 1.00 0.00 O ATOM 938 OE2 GLU A 63 38.714 -13.495 0.505 1.00 0.00 O ATOM 0 H GLU A 63 44.088 -14.944 -1.116 1.00 0.00 H new ATOM 0 HA GLU A 63 41.844 -16.446 0.065 1.00 0.00 H new ATOM 0 HB2 GLU A 63 42.720 -13.800 0.312 1.00 0.00 H new ATOM 0 HB3 GLU A 63 41.382 -13.679 -0.814 1.00 0.00 H new ATOM 0 HG2 GLU A 63 40.326 -15.347 1.106 1.00 0.00 H new ATOM 0 HG3 GLU A 63 41.378 -14.330 2.071 1.00 0.00 H new ATOM 945 N TYR A 64 40.446 -16.675 -1.970 1.00 0.00 N ATOM 946 CA TYR A 64 39.699 -16.946 -3.192 1.00 0.00 C ATOM 947 C TYR A 64 38.227 -17.201 -2.886 1.00 0.00 C ATOM 948 O TYR A 64 37.810 -17.187 -1.728 1.00 0.00 O ATOM 949 CB TYR A 64 40.296 -18.151 -3.923 1.00 0.00 C ATOM 950 CG TYR A 64 40.236 -19.433 -3.124 1.00 0.00 C ATOM 951 CD1 TYR A 64 41.101 -19.654 -2.060 1.00 0.00 C ATOM 952 CD2 TYR A 64 39.313 -20.425 -3.434 1.00 0.00 C ATOM 953 CE1 TYR A 64 41.049 -20.825 -1.328 1.00 0.00 C ATOM 954 CE2 TYR A 64 39.253 -21.598 -2.707 1.00 0.00 C ATOM 955 CZ TYR A 64 40.124 -21.793 -1.656 1.00 0.00 C ATOM 956 OH TYR A 64 40.069 -22.960 -0.929 1.00 0.00 O ATOM 0 H TYR A 64 40.097 -17.164 -1.145 1.00 0.00 H new ATOM 0 HA TYR A 64 39.771 -16.068 -3.834 1.00 0.00 H new ATOM 0 HB2 TYR A 64 39.765 -18.294 -4.864 1.00 0.00 H new ATOM 0 HB3 TYR A 64 41.335 -17.936 -4.172 1.00 0.00 H new ATOM 0 HD1 TYR A 64 41.827 -18.898 -1.800 1.00 0.00 H new ATOM 0 HD2 TYR A 64 38.631 -20.276 -4.258 1.00 0.00 H new ATOM 0 HE1 TYR A 64 41.729 -20.981 -0.504 1.00 0.00 H new ATOM 0 HE2 TYR A 64 38.528 -22.358 -2.960 1.00 0.00 H new ATOM 0 HH TYR A 64 39.362 -23.536 -1.288 1.00 0.00 H new ATOM 966 N SER A 65 37.443 -17.435 -3.934 1.00 0.00 N ATOM 967 CA SER A 65 36.016 -17.691 -3.779 1.00 0.00 C ATOM 968 C SER A 65 35.586 -18.894 -4.612 1.00 0.00 C ATOM 969 O SER A 65 36.291 -19.312 -5.532 1.00 0.00 O ATOM 970 CB SER A 65 35.208 -16.458 -4.188 1.00 0.00 C ATOM 971 OG SER A 65 35.775 -15.275 -3.652 1.00 0.00 O ATOM 0 H SER A 65 37.772 -17.453 -4.899 1.00 0.00 H new ATOM 0 HA SER A 65 35.824 -17.911 -2.729 1.00 0.00 H new ATOM 0 HB2 SER A 65 35.172 -16.387 -5.275 1.00 0.00 H new ATOM 0 HB3 SER A 65 34.180 -16.562 -3.841 1.00 0.00 H new ATOM 0 HG SER A 65 35.241 -14.502 -3.929 1.00 0.00 H new ATOM 977 N LEU A 66 34.424 -19.448 -4.284 1.00 0.00 N ATOM 978 CA LEU A 66 33.897 -20.604 -5.001 1.00 0.00 C ATOM 979 C LEU A 66 32.503 -20.317 -5.550 1.00 0.00 C ATOM 980 O LEU A 66 31.628 -19.839 -4.828 1.00 0.00 O ATOM 981 CB LEU A 66 33.854 -21.824 -4.080 1.00 0.00 C ATOM 982 CG LEU A 66 35.207 -22.422 -3.692 1.00 0.00 C ATOM 983 CD1 LEU A 66 35.018 -23.624 -2.780 1.00 0.00 C ATOM 984 CD2 LEU A 66 35.994 -22.811 -4.935 1.00 0.00 C ATOM 0 H LEU A 66 33.828 -19.115 -3.526 1.00 0.00 H new ATOM 0 HA LEU A 66 34.561 -20.813 -5.840 1.00 0.00 H new ATOM 0 HB2 LEU A 66 33.327 -21.546 -3.167 1.00 0.00 H new ATOM 0 HB3 LEU A 66 33.263 -22.600 -4.566 1.00 0.00 H new ATOM 0 HG LEU A 66 35.774 -21.666 -3.149 1.00 0.00 H new ATOM 0 HD11 LEU A 66 35.992 -24.036 -2.515 1.00 0.00 H new ATOM 0 HD12 LEU A 66 34.496 -23.315 -1.875 1.00 0.00 H new ATOM 0 HD13 LEU A 66 34.431 -24.384 -3.296 1.00 0.00 H new ATOM 0 HD21 LEU A 66 36.954 -23.235 -4.640 1.00 0.00 H new ATOM 0 HD22 LEU A 66 35.431 -23.550 -5.506 1.00 0.00 H new ATOM 0 HD23 LEU A 66 36.161 -21.927 -5.551 1.00 0.00 H new ATOM 996 N SER A 67 32.304 -20.613 -6.830 1.00 0.00 N ATOM 997 CA SER A 67 31.017 -20.385 -7.476 1.00 0.00 C ATOM 998 C SER A 67 30.415 -21.699 -7.967 1.00 0.00 C ATOM 999 O SER A 67 30.026 -21.822 -9.128 1.00 0.00 O ATOM 1000 CB SER A 67 31.175 -19.414 -8.648 1.00 0.00 C ATOM 1001 OG SER A 67 32.065 -19.931 -9.621 1.00 0.00 O ATOM 0 H SER A 67 33.018 -21.011 -7.440 1.00 0.00 H new ATOM 0 HA SER A 67 30.342 -19.948 -6.740 1.00 0.00 H new ATOM 0 HB2 SER A 67 30.202 -19.227 -9.103 1.00 0.00 H new ATOM 0 HB3 SER A 67 31.546 -18.456 -8.283 1.00 0.00 H new ATOM 0 HG SER A 67 32.847 -19.344 -9.694 1.00 0.00 H new ATOM 1007 N LYS A 68 30.341 -22.679 -7.073 1.00 0.00 N ATOM 1008 CA LYS A 68 29.786 -23.984 -7.411 1.00 0.00 C ATOM 1009 C LYS A 68 29.152 -24.639 -6.189 1.00 0.00 C ATOM 1010 O LYS A 68 27.950 -24.902 -6.166 1.00 0.00 O ATOM 1011 CB LYS A 68 30.877 -24.892 -7.982 1.00 0.00 C ATOM 1012 CG LYS A 68 30.523 -25.495 -9.330 1.00 0.00 C ATOM 1013 CD LYS A 68 29.539 -26.644 -9.186 1.00 0.00 C ATOM 1014 CE LYS A 68 28.147 -26.248 -9.654 1.00 0.00 C ATOM 1015 NZ LYS A 68 27.839 -26.795 -11.004 1.00 0.00 N ATOM 0 H LYS A 68 30.659 -22.594 -6.108 1.00 0.00 H new ATOM 0 HA LYS A 68 29.012 -23.838 -8.165 1.00 0.00 H new ATOM 0 HB2 LYS A 68 31.799 -24.320 -8.080 1.00 0.00 H new ATOM 0 HB3 LYS A 68 31.075 -25.697 -7.274 1.00 0.00 H new ATOM 0 HG2 LYS A 68 30.094 -24.726 -9.972 1.00 0.00 H new ATOM 0 HG3 LYS A 68 31.430 -25.850 -9.820 1.00 0.00 H new ATOM 0 HD2 LYS A 68 29.889 -27.499 -9.765 1.00 0.00 H new ATOM 0 HD3 LYS A 68 29.497 -26.960 -8.144 1.00 0.00 H new ATOM 0 HE2 LYS A 68 27.407 -26.608 -8.939 1.00 0.00 H new ATOM 0 HE3 LYS A 68 28.067 -25.161 -9.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 26.882 -26.503 -11.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 28.529 -26.431 -11.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 27.890 -27.833 -10.978 1.00 0.00 H new ATOM 1029 N GLY A 69 29.968 -24.900 -5.172 1.00 0.00 N ATOM 1030 CA GLY A 69 29.468 -25.521 -3.960 1.00 0.00 C ATOM 1031 C GLY A 69 29.983 -26.935 -3.778 1.00 0.00 C ATOM 1032 O GLY A 69 30.746 -27.212 -2.851 1.00 0.00 O ATOM 0 H GLY A 69 30.967 -24.692 -5.166 1.00 0.00 H new ATOM 0 HA2 GLY A 69 29.759 -24.918 -3.100 1.00 0.00 H new ATOM 0 HA3 GLY A 69 28.378 -25.535 -3.985 1.00 0.00 H new ATOM 1036 N LYS A 70 29.566 -27.834 -4.662 1.00 0.00 N ATOM 1037 CA LYS A 70 29.989 -29.228 -4.596 1.00 0.00 C ATOM 1038 C LYS A 70 29.877 -29.896 -5.963 1.00 0.00 C ATOM 1039 O LYS A 70 28.778 -30.148 -6.453 1.00 0.00 O ATOM 1040 CB LYS A 70 29.145 -29.990 -3.573 1.00 0.00 C ATOM 1041 CG LYS A 70 29.936 -30.472 -2.369 1.00 0.00 C ATOM 1042 CD LYS A 70 29.082 -30.492 -1.112 1.00 0.00 C ATOM 1043 CE LYS A 70 29.939 -30.584 0.141 1.00 0.00 C ATOM 1044 NZ LYS A 70 29.876 -31.937 0.759 1.00 0.00 N ATOM 0 H LYS A 70 28.934 -27.622 -5.434 1.00 0.00 H new ATOM 0 HA LYS A 70 31.033 -29.251 -4.285 1.00 0.00 H new ATOM 0 HB2 LYS A 70 28.335 -29.346 -3.231 1.00 0.00 H new ATOM 0 HB3 LYS A 70 28.684 -30.849 -4.062 1.00 0.00 H new ATOM 0 HG2 LYS A 70 30.322 -31.473 -2.563 1.00 0.00 H new ATOM 0 HG3 LYS A 70 30.797 -29.822 -2.214 1.00 0.00 H new ATOM 0 HD2 LYS A 70 28.471 -29.590 -1.071 1.00 0.00 H new ATOM 0 HD3 LYS A 70 28.397 -31.339 -1.149 1.00 0.00 H new ATOM 0 HE2 LYS A 70 30.973 -30.347 -0.108 1.00 0.00 H new ATOM 0 HE3 LYS A 70 29.606 -29.839 0.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 30.473 -31.958 1.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 28.893 -32.154 1.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 30.217 -32.646 0.079 1.00 0.00 H new ATOM 1058 N GLY A 71 31.024 -30.182 -6.572 1.00 0.00 N ATOM 1059 CA GLY A 71 31.032 -30.820 -7.876 1.00 0.00 C ATOM 1060 C GLY A 71 32.312 -31.588 -8.138 1.00 0.00 C ATOM 1061 O GLY A 71 33.325 -31.363 -7.477 1.00 0.00 O ATOM 0 H GLY A 71 31.947 -29.984 -6.186 1.00 0.00 H new ATOM 0 HA2 GLY A 71 30.183 -31.499 -7.950 1.00 0.00 H new ATOM 0 HA3 GLY A 71 30.902 -30.062 -8.649 1.00 0.00 H new ATOM 1065 N ASN A 72 32.266 -32.500 -9.103 1.00 0.00 N ATOM 1066 CA ASN A 72 33.431 -33.307 -9.449 1.00 0.00 C ATOM 1067 C ASN A 72 34.642 -32.422 -9.727 1.00 0.00 C ATOM 1068 O ASN A 72 35.749 -32.702 -9.267 1.00 0.00 O ATOM 1069 CB ASN A 72 33.130 -34.177 -10.671 1.00 0.00 C ATOM 1070 CG ASN A 72 33.821 -35.525 -10.604 1.00 0.00 C ATOM 1071 OD1 ASN A 72 33.186 -36.569 -10.752 1.00 0.00 O ATOM 1072 ND2 ASN A 72 35.130 -35.508 -10.381 1.00 0.00 N ATOM 0 H ASN A 72 31.435 -32.699 -9.660 1.00 0.00 H new ATOM 0 HA ASN A 72 33.661 -33.951 -8.600 1.00 0.00 H new ATOM 0 HB2 ASN A 72 32.053 -34.327 -10.751 1.00 0.00 H new ATOM 0 HB3 ASN A 72 33.447 -33.654 -11.573 1.00 0.00 H new ATOM 0 HD21 ASN A 72 35.649 -36.384 -10.326 1.00 0.00 H new ATOM 0 HD22 ASN A 72 35.616 -34.619 -10.264 1.00 0.00 H new ATOM 1079 N LYS A 73 34.424 -31.351 -10.483 1.00 0.00 N ATOM 1080 CA LYS A 73 35.496 -30.422 -10.822 1.00 0.00 C ATOM 1081 C LYS A 73 35.152 -29.006 -10.370 1.00 0.00 C ATOM 1082 O LYS A 73 34.328 -28.330 -10.985 1.00 0.00 O ATOM 1083 CB LYS A 73 35.755 -30.439 -12.330 1.00 0.00 C ATOM 1084 CG LYS A 73 36.833 -31.422 -12.751 1.00 0.00 C ATOM 1085 CD LYS A 73 38.098 -30.706 -13.194 1.00 0.00 C ATOM 1086 CE LYS A 73 39.345 -31.492 -12.818 1.00 0.00 C ATOM 1087 NZ LYS A 73 40.327 -31.543 -13.936 1.00 0.00 N ATOM 0 H LYS A 73 33.514 -31.105 -10.873 1.00 0.00 H new ATOM 0 HA LYS A 73 36.399 -30.741 -10.301 1.00 0.00 H new ATOM 0 HB2 LYS A 73 34.828 -30.686 -12.847 1.00 0.00 H new ATOM 0 HB3 LYS A 73 36.042 -29.438 -12.652 1.00 0.00 H new ATOM 0 HG2 LYS A 73 37.063 -32.089 -11.920 1.00 0.00 H new ATOM 0 HG3 LYS A 73 36.462 -32.044 -13.565 1.00 0.00 H new ATOM 0 HD2 LYS A 73 38.073 -30.556 -14.273 1.00 0.00 H new ATOM 0 HD3 LYS A 73 38.138 -29.718 -12.735 1.00 0.00 H new ATOM 0 HE2 LYS A 73 39.812 -31.036 -11.945 1.00 0.00 H new ATOM 0 HE3 LYS A 73 39.063 -32.506 -12.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 41.162 -32.087 -13.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 39.890 -32.001 -14.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 40.616 -30.576 -14.189 1.00 0.00 H new ATOM 1101 N VAL A 74 35.791 -28.563 -9.291 1.00 0.00 N ATOM 1102 CA VAL A 74 35.554 -27.226 -8.759 1.00 0.00 C ATOM 1103 C VAL A 74 36.832 -26.394 -8.776 1.00 0.00 C ATOM 1104 O VAL A 74 37.867 -26.817 -8.262 1.00 0.00 O ATOM 1105 CB VAL A 74 35.012 -27.284 -7.318 1.00 0.00 C ATOM 1106 CG1 VAL A 74 34.770 -25.881 -6.782 1.00 0.00 C ATOM 1107 CG2 VAL A 74 33.737 -28.112 -7.262 1.00 0.00 C ATOM 0 H VAL A 74 36.476 -29.110 -8.769 1.00 0.00 H new ATOM 0 HA VAL A 74 34.809 -26.756 -9.401 1.00 0.00 H new ATOM 0 HB VAL A 74 35.759 -27.765 -6.686 1.00 0.00 H new ATOM 0 HG11 VAL A 74 34.387 -25.942 -5.763 1.00 0.00 H new ATOM 0 HG12 VAL A 74 35.707 -25.324 -6.785 1.00 0.00 H new ATOM 0 HG13 VAL A 74 34.042 -25.371 -7.413 1.00 0.00 H new ATOM 0 HG21 VAL A 74 33.368 -28.143 -6.237 1.00 0.00 H new ATOM 0 HG22 VAL A 74 32.982 -27.662 -7.906 1.00 0.00 H new ATOM 0 HG23 VAL A 74 33.946 -29.126 -7.603 1.00 0.00 H new ATOM 1117 N SER A 75 36.751 -25.208 -9.371 1.00 0.00 N ATOM 1118 CA SER A 75 37.901 -24.317 -9.458 1.00 0.00 C ATOM 1119 C SER A 75 37.646 -23.023 -8.690 1.00 0.00 C ATOM 1120 O SER A 75 36.542 -22.786 -8.202 1.00 0.00 O ATOM 1121 CB SER A 75 38.218 -24.001 -10.921 1.00 0.00 C ATOM 1122 OG SER A 75 37.135 -24.352 -11.765 1.00 0.00 O ATOM 0 H SER A 75 35.901 -24.842 -9.800 1.00 0.00 H new ATOM 0 HA SER A 75 38.756 -24.823 -9.009 1.00 0.00 H new ATOM 0 HB2 SER A 75 38.437 -22.938 -11.028 1.00 0.00 H new ATOM 0 HB3 SER A 75 39.113 -24.543 -11.228 1.00 0.00 H new ATOM 0 HG SER A 75 37.362 -24.139 -12.694 1.00 0.00 H new ATOM 1128 N ALA A 76 38.677 -22.190 -8.588 1.00 0.00 N ATOM 1129 CA ALA A 76 38.565 -20.920 -7.882 1.00 0.00 C ATOM 1130 C ALA A 76 38.375 -19.764 -8.858 1.00 0.00 C ATOM 1131 O ALA A 76 38.588 -19.915 -10.060 1.00 0.00 O ATOM 1132 CB ALA A 76 39.795 -20.687 -7.018 1.00 0.00 C ATOM 0 H ALA A 76 39.599 -22.372 -8.985 1.00 0.00 H new ATOM 0 HA ALA A 76 37.686 -20.966 -7.239 1.00 0.00 H new ATOM 0 HB1 ALA A 76 39.698 -19.735 -6.496 1.00 0.00 H new ATOM 0 HB2 ALA A 76 39.886 -21.492 -6.289 1.00 0.00 H new ATOM 0 HB3 ALA A 76 40.684 -20.666 -7.648 1.00 0.00 H new ATOM 1138 N GLU A 77 37.972 -18.612 -8.332 1.00 0.00 N ATOM 1139 CA GLU A 77 37.752 -17.431 -9.159 1.00 0.00 C ATOM 1140 C GLU A 77 38.243 -16.172 -8.451 1.00 0.00 C ATOM 1141 O GLU A 77 38.020 -15.991 -7.254 1.00 0.00 O ATOM 1142 CB GLU A 77 36.267 -17.291 -9.502 1.00 0.00 C ATOM 1143 CG GLU A 77 35.381 -17.062 -8.288 1.00 0.00 C ATOM 1144 CD GLU A 77 33.906 -17.039 -8.639 1.00 0.00 C ATOM 1145 OE1 GLU A 77 33.518 -17.710 -9.618 1.00 0.00 O ATOM 1146 OE2 GLU A 77 33.140 -16.351 -7.932 1.00 0.00 O ATOM 0 H GLU A 77 37.791 -18.471 -7.338 1.00 0.00 H new ATOM 0 HA GLU A 77 38.320 -17.553 -10.081 1.00 0.00 H new ATOM 0 HB2 GLU A 77 36.140 -16.460 -10.196 1.00 0.00 H new ATOM 0 HB3 GLU A 77 35.935 -18.192 -10.019 1.00 0.00 H new ATOM 0 HG2 GLU A 77 35.564 -17.848 -7.556 1.00 0.00 H new ATOM 0 HG3 GLU A 77 35.653 -16.118 -7.817 1.00 0.00 H new ATOM 1153 N LYS A 78 38.914 -15.303 -9.200 1.00 0.00 N ATOM 1154 CA LYS A 78 39.437 -14.060 -8.647 1.00 0.00 C ATOM 1155 C LYS A 78 40.287 -14.330 -7.409 1.00 0.00 C ATOM 1156 O LYS A 78 39.843 -14.116 -6.281 1.00 0.00 O ATOM 1157 CB LYS A 78 38.289 -13.111 -8.294 1.00 0.00 C ATOM 1158 CG LYS A 78 37.232 -13.006 -9.379 1.00 0.00 C ATOM 1159 CD LYS A 78 36.363 -11.773 -9.193 1.00 0.00 C ATOM 1160 CE LYS A 78 35.150 -12.071 -8.325 1.00 0.00 C ATOM 1161 NZ LYS A 78 34.153 -12.917 -9.037 1.00 0.00 N ATOM 0 H LYS A 78 39.108 -15.437 -10.192 1.00 0.00 H new ATOM 0 HA LYS A 78 40.067 -13.592 -9.404 1.00 0.00 H new ATOM 0 HB2 LYS A 78 37.818 -13.451 -7.371 1.00 0.00 H new ATOM 0 HB3 LYS A 78 38.696 -12.119 -8.098 1.00 0.00 H new ATOM 0 HG2 LYS A 78 37.714 -12.968 -10.356 1.00 0.00 H new ATOM 0 HG3 LYS A 78 36.606 -13.899 -9.367 1.00 0.00 H new ATOM 0 HD2 LYS A 78 36.952 -10.977 -8.736 1.00 0.00 H new ATOM 0 HD3 LYS A 78 36.034 -11.408 -10.166 1.00 0.00 H new ATOM 0 HE2 LYS A 78 35.471 -12.576 -7.414 1.00 0.00 H new ATOM 0 HE3 LYS A 78 34.681 -11.135 -8.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 33.233 -12.849 -8.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 34.055 -12.587 -10.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 34.473 -13.907 -9.035 1.00 0.00 H new ATOM 1175 N VAL A 79 41.511 -14.800 -7.628 1.00 0.00 N ATOM 1176 CA VAL A 79 42.423 -15.097 -6.530 1.00 0.00 C ATOM 1177 C VAL A 79 43.330 -13.908 -6.233 1.00 0.00 C ATOM 1178 O VAL A 79 43.682 -13.144 -7.130 1.00 0.00 O ATOM 1179 CB VAL A 79 43.294 -16.328 -6.841 1.00 0.00 C ATOM 1180 CG1 VAL A 79 44.131 -16.711 -5.630 1.00 0.00 C ATOM 1181 CG2 VAL A 79 42.427 -17.494 -7.291 1.00 0.00 C ATOM 0 H VAL A 79 41.894 -14.983 -8.556 1.00 0.00 H new ATOM 0 HA VAL A 79 41.808 -15.309 -5.656 1.00 0.00 H new ATOM 0 HB VAL A 79 43.973 -16.074 -7.655 1.00 0.00 H new ATOM 0 HG11 VAL A 79 44.740 -17.583 -5.869 1.00 0.00 H new ATOM 0 HG12 VAL A 79 44.780 -15.879 -5.359 1.00 0.00 H new ATOM 0 HG13 VAL A 79 43.474 -16.946 -4.793 1.00 0.00 H new ATOM 0 HG21 VAL A 79 43.059 -18.355 -7.507 1.00 0.00 H new ATOM 0 HG22 VAL A 79 41.722 -17.750 -6.500 1.00 0.00 H new ATOM 0 HG23 VAL A 79 41.877 -17.213 -8.190 1.00 0.00 H new ATOM 1191 N ASN A 80 43.705 -13.759 -4.966 1.00 0.00 N ATOM 1192 CA ASN A 80 44.572 -12.662 -4.550 1.00 0.00 C ATOM 1193 C ASN A 80 45.174 -12.937 -3.175 1.00 0.00 C ATOM 1194 O ASN A 80 44.475 -13.349 -2.249 1.00 0.00 O ATOM 1195 CB ASN A 80 43.789 -11.348 -4.522 1.00 0.00 C ATOM 1196 CG ASN A 80 42.783 -11.298 -3.389 1.00 0.00 C ATOM 1197 OD1 ASN A 80 41.629 -11.695 -3.550 1.00 0.00 O ATOM 1198 ND2 ASN A 80 43.218 -10.808 -2.234 1.00 0.00 N ATOM 0 H ASN A 80 43.422 -14.383 -4.211 1.00 0.00 H new ATOM 0 HA ASN A 80 45.383 -12.578 -5.273 1.00 0.00 H new ATOM 0 HB2 ASN A 80 44.485 -10.515 -4.423 1.00 0.00 H new ATOM 0 HB3 ASN A 80 43.270 -11.218 -5.471 1.00 0.00 H new ATOM 0 HD21 ASN A 80 42.587 -10.749 -1.435 1.00 0.00 H new ATOM 0 HD22 ASN A 80 44.183 -10.490 -2.146 1.00 0.00 H new ATOM 1205 N LYS A 81 46.477 -12.705 -3.049 1.00 0.00 N ATOM 1206 CA LYS A 81 47.175 -12.926 -1.789 1.00 0.00 C ATOM 1207 C LYS A 81 46.480 -12.191 -0.646 1.00 0.00 C ATOM 1208 O LYS A 81 45.721 -11.248 -0.871 1.00 0.00 O ATOM 1209 CB LYS A 81 48.629 -12.460 -1.899 1.00 0.00 C ATOM 1210 CG LYS A 81 49.565 -13.516 -2.461 1.00 0.00 C ATOM 1211 CD LYS A 81 50.688 -12.891 -3.272 1.00 0.00 C ATOM 1212 CE LYS A 81 51.936 -12.684 -2.428 1.00 0.00 C ATOM 1213 NZ LYS A 81 53.049 -12.091 -3.220 1.00 0.00 N ATOM 0 H LYS A 81 47.070 -12.364 -3.805 1.00 0.00 H new ATOM 0 HA LYS A 81 47.157 -13.995 -1.575 1.00 0.00 H new ATOM 0 HB2 LYS A 81 48.671 -11.575 -2.533 1.00 0.00 H new ATOM 0 HB3 LYS A 81 48.982 -12.162 -0.912 1.00 0.00 H new ATOM 0 HG2 LYS A 81 49.987 -14.101 -1.644 1.00 0.00 H new ATOM 0 HG3 LYS A 81 49.001 -14.206 -3.089 1.00 0.00 H new ATOM 0 HD2 LYS A 81 50.924 -13.531 -4.122 1.00 0.00 H new ATOM 0 HD3 LYS A 81 50.358 -11.934 -3.676 1.00 0.00 H new ATOM 0 HE2 LYS A 81 51.701 -12.032 -1.587 1.00 0.00 H new ATOM 0 HE3 LYS A 81 52.255 -13.639 -2.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 53.881 -11.966 -2.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 53.290 -12.725 -4.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 52.754 -11.168 -3.596 1.00 0.00 H new ATOM 1227 N THR A 82 46.746 -12.628 0.581 1.00 0.00 N ATOM 1228 CA THR A 82 46.146 -12.012 1.758 1.00 0.00 C ATOM 1229 C THR A 82 47.122 -12.000 2.929 1.00 0.00 C ATOM 1230 O THR A 82 47.835 -12.975 3.166 1.00 0.00 O ATOM 1231 CB THR A 82 44.861 -12.747 2.183 1.00 0.00 C ATOM 1232 OG1 THR A 82 44.321 -12.144 3.365 1.00 0.00 O ATOM 1233 CG2 THR A 82 45.140 -14.220 2.442 1.00 0.00 C ATOM 0 H THR A 82 47.373 -13.406 0.785 1.00 0.00 H new ATOM 0 HA THR A 82 45.896 -10.987 1.486 1.00 0.00 H new ATOM 0 HB THR A 82 44.138 -12.668 1.371 1.00 0.00 H new ATOM 0 HG1 THR A 82 43.503 -12.616 3.628 1.00 0.00 H new ATOM 0 HG21 THR A 82 44.218 -14.718 2.741 1.00 0.00 H new ATOM 0 HG22 THR A 82 45.524 -14.683 1.533 1.00 0.00 H new ATOM 0 HG23 THR A 82 45.878 -14.316 3.238 1.00 0.00 H new ATOM 1241 N SER A 83 47.149 -10.889 3.659 1.00 0.00 N ATOM 1242 CA SER A 83 48.041 -10.749 4.804 1.00 0.00 C ATOM 1243 C SER A 83 49.487 -11.028 4.405 1.00 0.00 C ATOM 1244 O SER A 83 49.977 -12.147 4.547 1.00 0.00 O ATOM 1245 CB SER A 83 47.618 -11.699 5.926 1.00 0.00 C ATOM 1246 OG SER A 83 46.207 -11.825 5.983 1.00 0.00 O ATOM 0 H SER A 83 46.564 -10.073 3.478 1.00 0.00 H new ATOM 0 HA SER A 83 47.973 -9.722 5.162 1.00 0.00 H new ATOM 0 HB2 SER A 83 48.068 -12.679 5.766 1.00 0.00 H new ATOM 0 HB3 SER A 83 47.992 -11.329 6.881 1.00 0.00 H new ATOM 0 HG SER A 83 45.962 -12.439 6.707 1.00 0.00 H new ATOM 1252 N GLY A 84 50.164 -9.999 3.903 1.00 0.00 N ATOM 1253 CA GLY A 84 51.547 -10.153 3.490 1.00 0.00 C ATOM 1254 C GLY A 84 52.199 -8.829 3.144 1.00 0.00 C ATOM 1255 O GLY A 84 51.569 -7.772 3.186 1.00 0.00 O ATOM 0 H GLY A 84 49.780 -9.063 3.775 1.00 0.00 H new ATOM 0 HA2 GLY A 84 52.110 -10.634 4.290 1.00 0.00 H new ATOM 0 HA3 GLY A 84 51.593 -10.814 2.625 1.00 0.00 H new ATOM 1259 N PRO A 85 53.493 -8.876 2.794 1.00 0.00 N ATOM 1260 CA PRO A 85 54.260 -7.679 2.434 1.00 0.00 C ATOM 1261 C PRO A 85 53.819 -7.089 1.099 1.00 0.00 C ATOM 1262 O PRO A 85 53.029 -7.692 0.373 1.00 0.00 O ATOM 1263 CB PRO A 85 55.698 -8.194 2.342 1.00 0.00 C ATOM 1264 CG PRO A 85 55.563 -9.645 2.031 1.00 0.00 C ATOM 1265 CD PRO A 85 54.308 -10.101 2.723 1.00 0.00 C ATOM 0 HA PRO A 85 54.126 -6.875 3.158 1.00 0.00 H new ATOM 0 HB2 PRO A 85 56.256 -7.673 1.564 1.00 0.00 H new ATOM 0 HB3 PRO A 85 56.235 -8.038 3.278 1.00 0.00 H new ATOM 0 HG2 PRO A 85 55.497 -9.809 0.955 1.00 0.00 H new ATOM 0 HG3 PRO A 85 56.429 -10.203 2.386 1.00 0.00 H new ATOM 0 HD2 PRO A 85 53.803 -10.888 2.162 1.00 0.00 H new ATOM 0 HD3 PRO A 85 54.519 -10.501 3.715 1.00 0.00 H new ATOM 1273 N SER A 86 54.335 -5.905 0.782 1.00 0.00 N ATOM 1274 CA SER A 86 53.992 -5.232 -0.465 1.00 0.00 C ATOM 1275 C SER A 86 55.215 -4.547 -1.067 1.00 0.00 C ATOM 1276 O SER A 86 55.704 -4.944 -2.125 1.00 0.00 O ATOM 1277 CB SER A 86 52.884 -4.204 -0.225 1.00 0.00 C ATOM 1278 OG SER A 86 51.754 -4.804 0.383 1.00 0.00 O ATOM 0 H SER A 86 54.991 -5.393 1.371 1.00 0.00 H new ATOM 0 HA SER A 86 53.635 -5.984 -1.169 1.00 0.00 H new ATOM 0 HB2 SER A 86 53.259 -3.402 0.410 1.00 0.00 H new ATOM 0 HB3 SER A 86 52.593 -3.751 -1.173 1.00 0.00 H new ATOM 0 HG SER A 86 51.061 -4.126 0.527 1.00 0.00 H new ATOM 1284 N SER A 87 55.704 -3.517 -0.385 1.00 0.00 N ATOM 1285 CA SER A 87 56.868 -2.773 -0.854 1.00 0.00 C ATOM 1286 C SER A 87 57.532 -2.022 0.297 1.00 0.00 C ATOM 1287 O SER A 87 56.885 -1.251 1.004 1.00 0.00 O ATOM 1288 CB SER A 87 56.463 -1.791 -1.954 1.00 0.00 C ATOM 1289 OG SER A 87 56.346 -0.474 -1.443 1.00 0.00 O ATOM 0 H SER A 87 55.313 -3.178 0.494 1.00 0.00 H new ATOM 0 HA SER A 87 57.585 -3.486 -1.261 1.00 0.00 H new ATOM 0 HB2 SER A 87 57.203 -1.810 -2.754 1.00 0.00 H new ATOM 0 HB3 SER A 87 55.514 -2.101 -2.391 1.00 0.00 H new ATOM 0 HG SER A 87 56.320 -0.504 -0.464 1.00 0.00 H new ATOM 1295 N GLY A 88 58.829 -2.254 0.477 1.00 0.00 N ATOM 1296 CA GLY A 88 59.560 -1.592 1.542 1.00 0.00 C ATOM 1297 C GLY A 88 60.035 -0.208 1.146 1.00 0.00 C ATOM 1298 O GLY A 88 60.507 -0.003 0.028 1.00 0.00 O ATOM 0 H GLY A 88 59.386 -2.888 -0.095 1.00 0.00 H new ATOM 0 HA2 GLY A 88 58.923 -1.516 2.423 1.00 0.00 H new ATOM 0 HA3 GLY A 88 60.419 -2.201 1.822 1.00 0.00 H new TER 1302 GLY A 88